0 B5R0.5 B(C(C)C)(O)O TS56191 [0,0,0,0,0,0|2,1,0]=3 1 B5R0.5 B([S+](C)C)(Cl)Cl TS07057 [0,0,0,0,0,0|4,0,0]=4 2 B5R0.5 C(C(Br)Br)(Br)Br TS78763 [0,0,0,0,0,0|4,0,0]=4 3 B5R0.5 C(C(Cl)Br)(Cl)Br TS67935 [0,0,0,0,0,0|4,0,0]=4 4 B5R0.5 C(C(Cl)Cl)(Cl)Cl TS29472 [0,0,0,0,0,0|4,0,0]=4 5 B5R0.5 C(C(Cl)Cl)(F)Cl TS41059 [0,0,0,0,0,0|4,0,0]=4 6 B5R0.5 C(C(Cl)Cl)(F)F TS36900 [0,0,0,0,0,0|4,0,0]=4 7 B5R0.5 C(C(F)Cl)(F)Cl TS36901 [0,0,0,0,0,0|4,0,0]=4 8 B5R0.5 C(C(F)F)(F)F TS31573 [0,0,0,0,0,0|4,0,0]=4 9 B5R0.5 CC(=C(C)Br)C TS07531 [0,0,0,0,0,0|1,0,2]=3 10 B5R0.5 CC(=C(C)C)C TS71721 [0,0,0,0,0,0|1,0,2]=3 11 B5R0.5 CC(=C(C)[NH3+])C TS04005 [0,0,0,0,0,0|1,0,2]=3 12 B5R0.5 CC(=C)C(=C)C TS71685 [0,0,0,0,0,0|1,0,3]=4 13 B5R0.5 CC(=C)C(=O)C TS03485 [0,0,0,0,0,0|0,1,3]=4 14 B5R0.5 CC(=O)C(=O)C TS03530 [0,0,0,0,0,0|1,1,2]=4 15 B5R0.5 CC(=O)C(Cl)Cl TS36198 [0,0,0,0,0,0|2,1,1]=4 16 B5R0.5 CC(=O)C(F)F TS03662 [0,0,0,0,0,0|2,1,1]=4 17 B5R0.5 CC(=O)C(O)O TS46028 [0,0,0,0,0,0|2,1,1]=4 18 B5R0.5 CC(=O)N(C)C TS03557 [0,0,0,0,0,0|1,1,1]=3 19 B5R0.5 CC(=S)N(C)C TS04015 [0,0,0,0,0,0|1,0,2]=3 20 B5R0.5 CC(C(=C)C)O TS71758 [0,0,0,0,0,0|0,1,2]=3 21 B5R0.5 CC(C(=O)Br)Br TS93904 [0,0,0,0,0,0|2,1,1]=4 22 B5R0.5 CC(C(=O)C)Br TS40972 [0,0,0,0,0,0|1,1,1]=3 23 B5R0.5 CC(C(=O)C)Cl TS31738 [0,0,0,0,0,0|1,1,1]=3 24 B5R0.5 CC(C(=O)C)F TS71828 [0,0,0,0,0,0|1,1,1]=3 25 B5R0.5 CC(C(=O)C)O TS03581 [0,0,0,0,0,0|1,1,1]=3 26 B5R0.5 CC(C(=O)C)S TS60015 [0,0,0,0,0,0|1,0,1]=2 27 B5R0.5 CC(C(=O)Cl)Br TS45375 [0,0,0,0,0,0|2,1,1]=4 28 B5R0.5 CC(C(=O)Cl)Cl TS36199 [0,0,0,0,0,0|2,1,1]=4 29 B5R0.5 CC(C(=O)N)Br TS10108 [0,0,0,0,0,0|2,1,1]=4 30 B5R0.5 CC(C(=O)N)Cl TS04116 [0,0,0,0,0,0|2,1,1]=4 31 B5R0.5 CC(C(=O)N)O TS71825 [0,0,0,0,0,0|2,1,1]=4 32 B5R0.5 CC(C(=O)O)Br TS10263 [0,0,0,0,0,0|2,1,1]=4 33 B5R0.5 CC(C(=O)O)Br TS41327 [0,0,0,0,0,0|2,1,1]=4 34 B5R0.5 CC(C(=O)O)Cl TS04158 [0,0,0,0,0,0|2,1,1]=4 35 B5R0.5 CC(C(=O)O)F TS02005 [0,0,0,0,0,0|2,1,1]=4 36 B5R0.5 CC(C(=O)O)N TS71826 [0,0,0,0,0,0|2,1,1]=4 37 B5R0.5 CC(C(=O)O)O TS03619 [0,0,0,0,0,0|2,1,1]=4 38 B5R0.5 CC(C(=O)O)O TS69796 [0,0,0,0,0,0|2,1,1]=4 39 B5R0.5 CC(C(=O)O)S TS04090 [0,0,0,0,0,0|2,0,1]=3 40 B5R0.5 CC(C(=O)[O-])O TS04267 [0,0,0,0,0,0|2,1,1]=4 41 B5R0.5 CC(C(=O)[O-])O TS21805 [0,0,0,0,0,0|2,1,1]=4 42 B5R0.5 CC(C(=O)[O-])O TS25875 [0,0,0,0,0,0|2,1,1]=4 43 B5R0.5 CC(C(=O)[O-])O TS49421 [0,0,0,0,0,0|2,1,1]=4 44 B5R0.5 CC(C(=O)[O-])O TS53785 [0,0,0,0,0,0|2,1,1]=4 45 B5R0.5 CC(C(=O)[O-])O TS60724 [0,0,0,0,0,0|2,1,1]=4 46 B5R0.5 CC(C(=O)[O-])O TS67922 [0,0,0,0,0,0|2,1,1]=4 47 B5R0.5 CC(C(=O)[O-])O TS82339 [0,0,0,0,0,0|2,1,1]=4 48 B5R0.5 CC(C(=O)[O-])O TS93633 [0,0,0,0,0,0|2,1,1]=4 49 B5R0.5 CC(C(=O)[O-])O TS94684 [0,0,0,0,0,0|2,1,1]=4 50 B5R0.5 CC(C(=O)[O-])O TS94690 [0,0,0,0,0,0|2,1,1]=4 51 B5R0.5 CC(C(Br)Br)Br TS54386 [0,0,0,0,0,0|3,0,0]=3 52 B5R0.5 CC(C(C)Br)Br TS21965 [0,0,0,0,0,0|2,0,0]=2 53 B5R0.5 CC(C(C)O)O TS71844 [0,0,0,0,0,0|1,1,0]=2 54 B5R0.5 CC(C(C)S)O TS04106 [0,0,0,0,0,0|1,0,0]=1 55 B5R0.5 CC(C(C)S)S TS04935 [0,0,0,0,0,0|1,0,0]=1 56 B5R0.5 CC(C(Cl)Br)Br TS25943 [0,0,0,0,0,0|3,0,0]=3 57 B5R0.5 CC(C(Cl)Cl)Cl TS07384 [0,0,0,0,0,0|3,0,0]=3 58 B5R0.5 CC(C)C(=C)C TS71720 [0,0,0,0,0,0|1,0,1]=2 59 B5R0.5 CC(C)C(=N)N TS03540 [0,0,0,0,0,0|2,0,1]=3 60 B5R0.5 CC(C)C(=N)N TS32540 [0,0,0,0,0,0|2,0,1]=3 61 B5R0.5 CC(C)C(=O)Br TS40967 [0,0,0,0,0,0|1,1,1]=3 62 B5R0.5 CC(C)C(=O)C TS39716 [0,0,0,0,0,0|0,1,1]=2 63 B5R0.5 CC(C)C(=O)Cl TS31739 [0,0,0,0,0,0|1,1,1]=3 64 B5R0.5 CC(C)C(=O)F TS71829 [0,0,0,0,0,0|1,1,1]=3 65 B5R0.5 CC(C)C(=O)N TS01506 [0,0,0,0,0,0|1,1,1]=3 66 B5R0.5 CC(C)C(=O)O TS85221 [0,0,0,0,0,0|1,1,1]=3 67 B5R0.5 CC(C)C(=O)[O-] TS03660 [0,0,0,0,0,0|1,1,1]=3 68 B5R0.5 CC(C)C(=O)[O-] TS04185 [0,0,0,0,0,0|1,1,1]=3 69 B5R0.5 CC(C)C(=O)[O-] TS36146 [0,0,0,0,0,0|1,1,1]=3 70 B5R0.5 CC(C)C(=O)[O-] TS44540 [0,0,0,0,0,0|1,1,1]=3 71 B5R0.5 CC(C)C(C)Br TS08308 [0,0,0,0,0,0|1,0,0]=1 72 B5R0.5 CC(C)C(C)C TS03547 [0,0,0,0,0,0|1,0,0]=1 73 B5R0.5 CC(C)C(C)N TS71776 [0,0,0,0,0,0|1,0,0]=1 74 B5R0.5 CC(C)C(C)O TS03594 [0,0,0,0,0,0|0,1,0]=1 75 B5R0.5 CC(C)C(C)S TS31690 [0,0,0,0,0,0|0,0,0]=0 76 B5R0.5 CC(C)N(C)C TS71780 [0,0,0,0,0,0|2,0,0]=2 77 B5R0.5 CC(C)P(Cl)Cl TS07060 [0,0,0,0,0,0|3,0,0]=3 78 B5R0.5 CC(C)[N+](=O)[O-] TS00110 [0,0,0,0,0,0|2,1,0]=3 79 B5R0.5 CC(C)[SiH](C)C TS03987 [0,0,0,0,0,0|1,1,0]=2 80 B5R0.5 CN(C)C(=N)N TS04993 [0,0,0,0,0,0|3,0,1]=4 81 B5R0.5 CN(C)C(=O)Cl TS04117 [0,0,0,0,0,0|2,1,1]=4 82 B5R0.5 CN(C)C(=O)N TS03592 [0,0,0,0,0,0|2,1,1]=4 83 B5R0.5 CN(C)C(=O)O TS05907 [0,0,0,0,0,0|2,1,1]=4 84 B5R0.5 CN(C)C(=S)Cl TS09052 [0,0,0,0,0,0|2,0,2]=4 85 B5R0.5 CN(C)C(=S)[S-] TS04874 [0,0,0,0,0,0|2,0,2]=4 86 B5R0.5 CN(C)C(=S)[S-] TS11177 [0,0,0,0,0,0|2,0,2]=4 87 B5R0.5 CN(C)C(=S)[S-] TS40093 [0,0,0,0,0,0|2,0,2]=4 88 B5R0.5 CN(C)C(=S)[S-] TS60533 [0,0,0,0,0,0|2,0,2]=4 89 B5R0.5 CN(C)C(=[Se])N TS09993 [0,0,0,0,0,0|2,1,1]=4 90 B5R0.5 CN(C)C(F)F TS03692 [0,0,0,0,0,0|3,0,0]=3 91 B5R0.5 CN(C)N(C)C TS71805 [0,0,0,0,0,0|3,0,0]=3 92 B5R0.5 CN(C)P(Cl)Cl TS07154 [0,0,0,0,0,0|4,0,0]=4 93 B5R0.5 CP(C)P(C)C TS04888 [0,0,0,0,0,0|3,0,0]=3 94 B5R0.5 C[C@@H](C(=O)N)N TS01517 [0,0,0,0,0,0|2,1,1]=4 95 B5R0.5 C[C@@H](C(=O)N)N TS03590 [0,0,0,0,0,0|2,1,1]=4 96 B5R0.5 C[C@@H](C(=O)N)O TS59860 [0,0,0,0,0,0|2,1,1]=4 97 B5R0.5 C[C@@H](C(=O)O)Br TS10265 [0,0,0,0,0,0|2,1,1]=4 98 B5R0.5 C[C@@H](C(=O)O)Cl TS47157 [0,0,0,0,0,0|2,1,1]=4 99 B5R0.5 C[C@@H](C(=O)O)N TS01516 [0,0,0,0,0,0|2,1,1]=4 100 B5R0.5 C[C@@H](C(=O)O)N TS03624 [0,0,0,0,0,0|2,1,1]=4 101 B5R0.5 C[C@@H](C(=O)O)O TS39672 [0,0,0,0,0,0|2,1,1]=4 102 B5R0.5 C[C@@H](C(=O)[O-])O TS04266 [0,0,0,0,0,0|2,1,1]=4 103 B5R0.5 C[C@@H](C(=O)[O-])O TS05332 [0,0,0,0,0,0|2,1,1]=4 104 B5R0.5 C[C@@H](C(=O)[O-])O TS28972 [0,0,0,0,0,0|2,1,1]=4 105 B5R0.5 C[C@@H](C(C)C)N TS71787 [0,0,0,0,0,0|1,0,0]=1 106 B5R0.5 C[C@@H]([C@H](C)O)O TS85107 [0,0,0,0,0,0|1,1,0]=2 107 B5R0.5 C[C@H](C(=O)Cl)Cl TS94778 [0,0,0,0,0,0|2,1,1]=4 108 B5R0.5 C[C@H](C(=O)N)N TS46606 [0,0,0,0,0,0|2,1,1]=4 109 B5R0.5 C[C@H](C(=O)N)N TS60179 [0,0,0,0,0,0|2,1,1]=4 110 B5R0.5 C[C@H](C(=O)N)O TS71820 [0,0,0,0,0,0|2,1,1]=4 111 B5R0.5 C[C@H](C(=O)O)Br TS10264 [0,0,0,0,0,0|2,1,1]=4 112 B5R0.5 C[C@H](C(=O)O)O TS03621 [0,0,0,0,0,0|2,1,1]=4 113 B5R0.5 C[C@H](C(=O)[O-])O TS03708 [0,0,0,0,0,0|2,1,1]=4 114 B5R0.5 C[C@H](C(C)C)N TS71786 [0,0,0,0,0,0|1,0,0]=1 115 B5R0.5 C[C@H]([C@@H](C)O)O TS85106 [0,0,0,0,0,0|1,1,0]=2 116 B5R0.5 C[C@H]([C@H](C)O)O TS71842 [0,0,0,0,0,0|1,1,0]=2 117 B5R0.5 C[N+](=C(Cl)Cl)C TS42521 [0,0,0,0,0,0|3,0,1]=4 118 B4R0.1 B(=S(C)C)Cl TS31862 [1,0,0,0,0,0|3,0,0]=4 119 B4R0.1 B(CC)(O)O TS56140 [1,0,0,0,0,0|2,1,0]=4 120 B4R0.1 C(C(=O)N)S TS03643 [1,0,0,0,0,0|2,0,1]=4 121 B4R0.1 C(C(=O)O)S TS03656 [1,0,0,0,0,0|2,0,1]=4 122 B4R0.1 C(C(=O)[O-])S TS31805 [1,0,0,0,0,0|2,0,1]=4 123 B4R0.1 C(C(=O)[O-])S TS32044 [1,0,0,0,0,0|2,0,1]=4 124 B4R0.1 C(C(=O)[O-])S TS36493 [1,0,0,0,0,0|2,0,1]=4 125 B4R0.1 C(C(Br)Br)Br TS73580 [1,0,0,0,0,0|3,0,0]=4 126 B4R0.1 C(C(Cl)Cl)Cl TS36793 [1,0,0,0,0,0|3,0,0]=4 127 B4R0.1 C(C(Cl)Cl)O TS32138 [1,0,0,0,0,0|2,1,0]=4 128 B4R0.1 C(C(F)Br)Br TS38905 [1,0,0,0,0,0|3,0,0]=4 129 B4R0.1 C(C(F)Br)O TS06812 [1,0,0,0,0,0|2,1,0]=4 130 B4R0.1 C(C(F)Cl)Cl TS32265 [1,0,0,0,0,0|3,0,0]=4 131 B4R0.1 C(C(F)Cl)F TS03893 [1,0,0,0,0,0|3,0,0]=4 132 B4R0.1 C(C(F)F)Br TS59947 [1,0,0,0,0,0|3,0,0]=4 133 B4R0.1 C(C(F)F)Cl TS03892 [1,0,0,0,0,0|3,0,0]=4 134 B4R0.1 C(C(F)F)F TS03474 [1,0,0,0,0,0|3,0,0]=4 135 B4R0.1 C(C(F)F)I TS17398 [1,0,0,0,0,0|3,0,0]=4 136 B4R0.1 C(C(F)F)N TS32308 [1,0,0,0,0,0|3,0,0]=4 137 B4R0.1 C(C(F)F)N TS71678 [1,0,0,0,0,0|3,0,0]=4 138 B4R0.1 C(C(F)F)O TS34629 [1,0,0,0,0,0|2,1,0]=4 139 B4R0.1 CC(=C)CBr TS65907 [1,0,0,0,0,0|1,0,2]=4 140 B4R0.1 CC(=C)CCl TS00138 [1,0,0,0,0,0|1,0,2]=4 141 B4R0.1 CC(=C)CN TS02169 [1,0,0,0,0,0|1,0,2]=4 142 B4R0.1 CC(=C)CN TS04121 [1,0,0,0,0,0|1,0,2]=4 143 B4R0.1 CC(=C)CO TS00103 [1,0,0,0,0,0|0,1,2]=4 144 B4R0.1 CC(=C)CS TS71814 [1,0,0,0,0,0|0,0,2]=3 145 B4R0.1 CC(=C)OC TS00091 [1,0,0,0,0,0|1,0,2]=4 146 B4R0.1 CC(=C=O)C TS16967 [1,0,0,0,0,0|0,1,2]=4 147 B4R0.1 CC(=CBr)C TS36907 [1,0,0,0,0,0|1,0,2]=4 148 B4R0.1 CC(=N)OC TS31813 [1,0,0,0,0,0|2,0,1]=4 149 B4R0.1 CC(=NN)C TS71612 [1,0,0,0,0,0|2,0,1]=4 150 B4R0.1 CC(=NO)C TS03378 [1,0,0,0,0,0|1,1,1]=4 151 B4R0.1 CC(=O)CBr TS64992 [1,0,0,0,0,0|1,1,1]=4 152 B4R0.1 CC(=O)CCl TS71869 [1,0,0,0,0,0|1,1,1]=4 153 B4R0.1 CC(=O)CF TS71639 [1,0,0,0,0,0|1,1,1]=4 154 B4R0.1 CC(=O)CO TS39607 [1,0,0,0,0,0|1,1,1]=4 155 B4R0.1 CC(=O)NC TS16313 [1,0,0,0,0,0|1,1,1]=4 156 B4R0.1 CC(=O)OC TS03390 [1,0,0,0,0,0|1,1,1]=4 157 B4R0.1 CC(=O)SC TS71852 [1,0,0,0,0,0|1,1,1]=4 158 B4R0.1 CC(=[N+]=[N-])C TS03273 [1,0,0,0,0,0|2,0,1]=4 159 B4R0.1 CC(C#C)N TS00055 [1,0,0,0,0,0|1,0,2]=4 160 B4R0.1 CC(C#C)N TS31716 [1,0,0,0,0,0|1,0,2]=4 161 B4R0.1 CC(C#C)O TS09825 [1,0,0,0,0,0|0,1,2]=4 162 B4R0.1 CC(C#N)Br TS05856 [1,0,0,0,0,0|2,0,1]=4 163 B4R0.1 CC(C#N)N TS03358 [1,0,0,0,0,0|2,0,1]=4 164 B4R0.1 CC(C#N)O TS03374 [1,0,0,0,0,0|1,1,1]=4 165 B4R0.1 CC(C)C#C TS71006 [1,0,0,0,0,0|0,0,2]=3 166 B4R0.1 CC(C)C#N TS03177 [1,0,0,0,0,0|1,0,1]=3 167 B4R0.1 CC(C)C=O TS00105 [1,0,0,0,0,0|0,1,1]=3 168 B4R0.1 CC(C)CBr TS59896 [1,0,0,0,0,0|1,0,0]=2 169 B4R0.1 CC(C)CCl TS00045 [1,0,0,0,0,0|1,0,0]=2 170 B4R0.1 CC(C)CI TS48514 [1,0,0,0,0,0|1,0,0]=2 171 B4R0.1 CC(C)CN TS01504 [1,0,0,0,0,0|1,0,0]=2 172 B4R0.1 CC(C)CN TS04173 [1,0,0,0,0,0|1,0,0]=2 173 B4R0.1 CC(C)CO TS03402 [1,0,0,0,0,0|0,1,0]=2 174 B4R0.1 CC(C)CS TS02444 [1,0,0,0,0,0|0,0,0]=1 175 B4R0.1 CC(C)C[Al+2] TS10535 [1,0,0,0,0,0|1,0,0]=2 176 B4R0.1 CC(C)C[Zn+] TS19475 [1,0,0,0,0,0|1,0,0]=2 177 B4R0.1 CC(C)NC TS56405 [1,0,0,0,0,0|1,0,0]=2 178 B4R0.1 CC(C)NN TS01925 [1,0,0,0,0,0|2,0,0]=3 179 B4R0.1 CC(C)NO TS04257 [1,0,0,0,0,0|1,1,0]=3 180 B4R0.1 CC(C)NO TS71633 [1,0,0,0,0,0|1,1,0]=3 181 B4R0.1 CC(C)ON TS93804 [1,0,0,0,0,0|2,0,0]=3 182 B4R0.1 CC(C)SC TS71855 [1,0,0,0,0,0|1,0,0]=2 183 B4R0.1 CC(C)[Mg]Br TS07379 [1,0,0,0,0,0|2,0,0]=3 184 B4R0.1 CC(C)[Mg]Cl TS31622 [1,0,0,0,0,0|2,0,0]=3 185 B4R0.1 CC(C)[N+]#[C-] TS03159 [1,0,0,0,0,0|1,0,1]=3 186 B4R0.1 CC(C=C)Br TS36909 [1,0,0,0,0,0|1,0,2]=4 187 B4R0.1 CC(C=C)Cl TS03635 [1,0,0,0,0,0|1,0,2]=4 188 B4R0.1 CC(C=C)O TS71610 [1,0,0,0,0,0|0,1,2]=4 189 B4R0.1 CC(CBr)Cl TS41830 [1,0,0,0,0,0|2,0,0]=3 190 B4R0.1 CC(CBr)O TS06336 [1,0,0,0,0,0|1,1,0]=3 191 B4R0.1 CC(CCl)Cl TS31995 [1,0,0,0,0,0|2,0,0]=3 192 B4R0.1 CC(CCl)O TS03686 [1,0,0,0,0,0|1,1,0]=3 193 B4R0.1 CC(CF)O TS03431 [1,0,0,0,0,0|1,1,0]=3 194 B4R0.1 CC(CN)N TS16685 [1,0,0,0,0,0|2,0,0]=3 195 B4R0.1 CC(CN)O TS71630 [1,0,0,0,0,0|1,1,0]=3 196 B4R0.1 CC(CO)F TS03432 [1,0,0,0,0,0|1,1,0]=3 197 B4R0.1 CC(CO)N TS04255 [1,0,0,0,0,0|1,1,0]=3 198 B4R0.1 CC(CO)O TS22730 [1,0,0,0,0,0|1,1,0]=3 199 B4R0.1 CC(CS)O TS71863 [1,0,0,0,0,0|1,0,0]=2 200 B4R0.1 CC(CS)S TS04156 [1,0,0,0,0,0|1,0,0]=2 201 B4R0.1 CC(C[NH3+])O TS45584 [1,0,0,0,0,0|1,1,0]=3 202 B4R0.1 CC(S)SC TS04152 [1,0,0,0,0,0|1,0,0]=2 203 B4R0.1 CC=C(C)Br TS36906 [1,0,0,0,0,0|1,0,2]=4 204 B4R0.1 CC=C(C)C TS03364 [1,0,0,0,0,0|0,0,2]=3 205 B4R0.1 CCC(=C)Br TS36908 [1,0,0,0,0,0|1,0,2]=4 206 B4R0.1 CCC(=C)C TS03363 [1,0,0,0,0,0|0,0,2]=3 207 B4R0.1 CCC(=C)Cl TS03633 [1,0,0,0,0,0|1,0,2]=4 208 B4R0.1 CCC(=N)N TS01647 [1,0,0,0,0,0|2,0,1]=4 209 B4R0.1 CCC(=O)Br TS06155 [1,0,0,0,0,0|1,1,1]=4 210 B4R0.1 CCC(=O)C TS71608 [1,0,0,0,0,0|0,1,1]=3 211 B4R0.1 CCC(=O)Cl TS71868 [1,0,0,0,0,0|1,1,1]=4 212 B4R0.1 CCC(=O)F TS71638 [1,0,0,0,0,0|1,1,1]=4 213 B4R0.1 CCC(=O)N TS59820 [1,0,0,0,0,0|1,1,1]=4 214 B4R0.1 CCC(=O)O TS03391 [1,0,0,0,0,0|1,1,1]=4 215 B4R0.1 CCC(=O)[O-] TS03709 [1,0,0,0,0,0|1,1,1]=4 216 B4R0.1 CCC(=O)[O-] TS04307 [1,0,0,0,0,0|1,1,1]=4 217 B4R0.1 CCC(=O)[O-] TS21191 [1,0,0,0,0,0|1,1,1]=4 218 B4R0.1 CCC(=O)[O-] TS28396 [1,0,0,0,0,0|1,1,1]=4 219 B4R0.1 CCC(=O)[O-] TS29272 [1,0,0,0,0,0|1,1,1]=4 220 B4R0.1 CCC(=O)[O-] TS38909 [1,0,0,0,0,0|1,1,1]=4 221 B4R0.1 CCC(=O)[O-] TS48904 [1,0,0,0,0,0|1,1,1]=4 222 B4R0.1 CCC(=O)[O-] TS53540 [1,0,0,0,0,0|1,1,1]=4 223 B4R0.1 CCC(=S)N TS03610 [1,0,0,0,0,0|1,0,2]=4 224 B4R0.1 CCC(=S)O TS71850 [1,0,0,0,0,0|1,0,2]=4 225 B4R0.1 CCC(C)Br TS39654 [1,0,0,0,0,0|1,0,0]=2 226 B4R0.1 CCC(C)Cl TS71870 [1,0,0,0,0,0|1,0,0]=2 227 B4R0.1 CCC(C)I TS93849 [1,0,0,0,0,0|1,0,0]=2 228 B4R0.1 CCC(C)N TS03382 [1,0,0,0,0,0|1,0,0]=2 229 B4R0.1 CCC(C)O TS03403 [1,0,0,0,0,0|0,1,0]=2 230 B4R0.1 CCC(C)S TS71856 [1,0,0,0,0,0|0,0,0]=1 231 B4R0.1 CCC(C)[Zn+] TS19473 [1,0,0,0,0,0|1,0,0]=2 232 B4R0.1 CCN(C)C TS03385 [1,0,0,0,0,0|1,0,0]=2 233 B4R0.1 CCP(Cl)Cl TS36582 [1,0,0,0,0,0|3,0,0]=4 234 B4R0.1 CCS(=O)[O-] TS93504 [1,0,0,0,0,0|2,1,0]=4 235 B4R0.1 CC[C@@H](C)N TS04171 [1,0,0,0,0,0|1,0,0]=2 236 B4R0.1 CC[C@@H](C)O TS03406 [1,0,0,0,0,0|0,1,0]=2 237 B4R0.1 CC[C@H](C)O TS03405 [1,0,0,0,0,0|0,1,0]=2 238 B4R0.1 CC[N+](=O)[O-] TS56409 [1,0,0,0,0,0|2,1,0]=4 239 B4R0.1 CC[SiH](C)C TS71815 [1,0,0,0,0,0|0,1,0]=2 240 B4R0.1 CC[SiH](Cl)Cl TS36387 [1,0,0,0,0,0|2,1,0]=4 241 B4R0.1 CN(C)C=O TS01574 [1,0,0,0,0,0|1,1,1]=4 242 B4R0.1 CN(C)C=O TS03397 [1,0,0,0,0,0|1,1,1]=4 243 B4R0.1 CN(C)C=O TS31811 [1,0,0,0,0,0|1,1,1]=4 244 B4R0.1 CN(C)C=O TS41262 [1,0,0,0,0,0|1,1,1]=4 245 B4R0.1 CN(C)N=O TS03395 [1,0,0,0,0,0|2,1,0]=4 246 B4R0.1 CNN(C)C TS01930 [1,0,0,0,0,0|2,0,0]=3 247 B4R0.1 COC(Cl)Cl TS32137 [1,0,0,0,0,0|3,0,0]=4 248 B4R0.1 CO[SiH](C)C TS03629 [1,0,0,0,0,0|1,1,0]=3 249 B4R0.1 C[C@@H](C#C)O TS09824 [1,0,0,0,0,0|0,1,2]=4 250 B4R0.1 C[C@@H](CCl)O TS08924 [1,0,0,0,0,0|1,1,0]=3 251 B4R0.1 C[C@@H](CN)N TS45459 [1,0,0,0,0,0|2,0,0]=3 252 B4R0.1 C[C@@H](CN)N TS59565 [1,0,0,0,0,0|2,0,0]=3 253 B4R0.1 C[C@@H](CN)O TS71634 [1,0,0,0,0,0|1,1,0]=3 254 B4R0.1 C[C@@H](CO)Cl TS31359 [1,0,0,0,0,0|1,1,0]=3 255 B4R0.1 C[C@@H](CO)N TS55878 [1,0,0,0,0,0|1,1,0]=3 256 B4R0.1 C[C@@H](CO)O TS46640 [1,0,0,0,0,0|1,1,0]=3 257 B4R0.1 C[C@H](C#C)O TS01975 [1,0,0,0,0,0|0,1,2]=4 258 B4R0.1 C[C@H](CCl)O TS46601 [1,0,0,0,0,0|1,1,0]=3 259 B4R0.1 C[C@H](CN)N TS31866 [1,0,0,0,0,0|2,0,0]=3 260 B4R0.1 C[C@H](CN)N TS45458 [1,0,0,0,0,0|2,0,0]=3 261 B4R0.1 C[C@H](CN)O TS71631 [1,0,0,0,0,0|1,1,0]=3 262 B4R0.1 C[C@H](CO)Cl TS03688 [1,0,0,0,0,0|1,1,0]=3 263 B4R0.1 C[C@H](CO)N TS01415 [1,0,0,0,0,0|1,1,0]=3 264 B4R0.1 C[C@H](CO)O TS59482 [1,0,0,0,0,0|1,1,0]=3 265 B4R0.1 C[N+](=CBr)C TS22154 [1,0,0,0,0,0|2,0,1]=4 266 B4R0.1 C[N+](=CCl)C TS05301 [1,0,0,0,0,0|2,0,1]=4 267 B4R0.1 C[SiH](C)CCl TS04166 [1,0,0,0,0,0|1,1,0]=3 268 B6R0.3 B(C(C)CC)(O)O TS85136 [0,1,0,0,0,0|2,1,0]=4 269 B6R0.3 CC(=O)N(C)OC TS56410 [0,1,0,0,0,0|1,1,1]=4 270 B6R0.3 CC(C(=O)C)SC TS32356 [0,1,0,0,0,0|0,1,1]=3 271 B6R0.3 CC(C(=O)O)NC TS31640 [0,1,0,0,0,0|1,1,1]=4 272 B6R0.3 CC(C(=O)OC)Br TS12330 [0,1,0,0,0,0|1,1,1]=4 273 B6R0.3 CC(C(=O)OC)Br TS93879 [0,1,0,0,0,0|1,1,1]=4 274 B6R0.3 CC(C(=O)OC)Cl TS04944 [0,1,0,0,0,0|1,1,1]=4 275 B6R0.3 CC(C(=O)OC)N TS55725 [0,1,0,0,0,0|1,1,1]=4 276 B6R0.3 CC(C(=O)OC)O TS31661 [0,1,0,0,0,0|1,1,1]=4 277 B6R0.3 CC(C(CBr)Br)Br TS35748 [0,1,0,0,0,0|2,0,0]=3 278 B6R0.3 CC(C(CO)O)O TS04083 [0,1,0,0,0,0|1,1,0]=3 279 B6R0.3 CC(C)C(=N)OC TS37144 [0,1,0,0,0,0|1,0,1]=3 280 B6R0.3 CC(C)C(=NO)N TS31597 [0,1,0,0,0,0|1,1,1]=4 281 B6R0.3 CC(C)C(=O)CBr TS00029 [0,1,0,0,0,0|0,1,1]=3 282 B6R0.3 CC(C)C(=O)NN TS31595 [0,1,0,0,0,0|1,1,1]=4 283 B6R0.3 CC(C)C(=O)NN TS66305 [0,1,0,0,0,0|1,1,1]=4 284 B6R0.3 CC(C)C(=O)NO TS03991 [0,1,0,0,0,0|1,1,1]=4 285 B6R0.3 CC(C)C(=O)OC TS03944 [0,1,0,0,0,0|0,1,1]=3 286 B6R0.3 CC(C)C(=O)O[SiH3] TS32367 [0,1,0,0,0,0|0,2,1]=4 287 B6R0.3 CC(C)C(C#C)O TS31442 [0,1,0,0,0,0|0,1,1]=3 288 B6R0.3 CC(C)C(C)C=C TS03806 [0,1,0,0,0,0|1,0,0]=2 289 B6R0.3 CC(C)C(C=C)O TS31528 [0,1,0,0,0,0|0,1,1]=3 290 B6R0.3 CC(C)C(CBr)Br TS52924 [0,1,0,0,0,0|1,0,0]=2 291 B6R0.3 CC(C)C(CO)S TS32435 [0,1,0,0,0,0|0,0,0]=1 292 B6R0.3 CC(C)[C@@H](CO)N TS56215 [0,1,0,0,0,0|1,0,0]=2 293 B6R0.3 CC(C)[C@H](CO)N TS08466 [0,1,0,0,0,0|1,0,0]=2 294 B6R0.3 CC(C=C)C(=C)C TS03723 [0,1,0,0,0,0|1,0,2]=4 295 B6R0.3 CC(CN)C(=O)O TS04859 [0,1,0,0,0,0|1,1,1]=4 296 B6R0.3 CC(CN)C(=O)O TS31641 [0,1,0,0,0,0|1,1,1]=4 297 B6R0.3 CC(CO)C(=O)C TS03953 [0,1,0,0,0,0|0,1,1]=3 298 B6R0.3 CC(CO)N(C)C TS04003 [0,1,0,0,0,0|1,1,0]=3 299 B6R0.3 CC(CO)[N+](=O)[O-] TS04065 [0,1,0,0,0,0|2,1,0]=4 300 B6R0.3 CC(CS)C(=O)O TS04823 [0,1,0,0,0,0|1,1,1]=4 301 B6R0.3 CC=C(C)C(=O)C TS31447 [0,1,0,0,0,0|0,1,2]=4 302 B6R0.3 CC=C(C)C(C)C TS03807 [0,1,0,0,0,0|1,0,1]=3 303 B6R0.3 CC=C(C)C(C)C TS31450 [0,1,0,0,0,0|1,0,1]=3 304 B6R0.3 CCC(=C)C(C)C TS03792 [0,1,0,0,0,0|1,0,1]=3 305 B6R0.3 CCC(=O)C(C)C TS31520 [0,1,0,0,0,0|0,1,1]=3 306 B6R0.3 CCC(=O)N(C)C TS31553 [0,1,0,0,0,0|1,1,1]=4 307 B6R0.3 CCC(C(=C)C)O TS31517 [0,1,0,0,0,0|0,1,2]=4 308 B6R0.3 CCC(C(=O)C)S TS32355 [0,1,0,0,0,0|1,0,1]=3 309 B6R0.3 CCC(C(C)Br)Br TS52927 [0,1,0,0,0,0|2,0,0]=3 310 B6R0.3 CCC(C(C)C)O TS03969 [0,1,0,0,0,0|0,1,0]=2 311 B6R0.3 CCC(C(C)Cl)Cl TS06555 [0,1,0,0,0,0|2,0,0]=3 312 B6R0.3 CCC(C)C(=O)C TS31518 [0,1,0,0,0,0|0,1,1]=3 313 B6R0.3 CCC(C)C(=O)Cl TS04836 [0,1,0,0,0,0|1,1,1]=4 314 B6R0.3 CCC(C)C(=O)O TS03945 [0,1,0,0,0,0|1,1,1]=4 315 B6R0.3 CCC(C)C(C)C TS03882 [0,1,0,0,0,0|1,0,0]=2 316 B6R0.3 CCC(C)C(C)O TS03961 [0,1,0,0,0,0|0,1,0]=2 317 B6R0.3 CCC(C)N(C)C TS03924 [0,1,0,0,0,0|2,0,0]=3 318 B6R0.3 CN(C)C(=N)OC TS31601 [0,1,0,0,0,0|2,0,1]=4 319 B6R0.3 CN(C)C(=O)CCl TS55283 [0,1,0,0,0,0|1,1,1]=4 320 B6R0.3 CN(C)C(=O)CN TS00812 [0,1,0,0,0,0|1,1,1]=4 321 B6R0.3 CN(C)C(=O)CN TS40036 [0,1,0,0,0,0|1,1,1]=4 322 B6R0.3 CNC(=O)N(C)C TS31600 [0,1,0,0,0,0|1,1,1]=4 323 B6R0.3 CNC(=S)N(C)C TS32366 [0,1,0,0,0,0|1,0,2]=4 324 B6R0.3 C[C@@H](C(=O)O)NC TS31642 [0,1,0,0,0,0|1,1,1]=4 325 B6R0.3 C[C@@H](C(=O)O)NC TS37312 [0,1,0,0,0,0|1,1,1]=4 326 B6R0.3 C[C@@H](C(=O)O)OC TS31663 [0,1,0,0,0,0|1,1,1]=4 327 B6R0.3 C[C@@H](C(=O)OC)N TS37314 [0,1,0,0,0,0|1,1,1]=4 328 B6R0.3 C[C@@H](C(=O)OC)O TS39673 [0,1,0,0,0,0|1,1,1]=4 329 B6R0.3 C[C@@H](CO)C(=O)O TS04019 [0,1,0,0,0,0|1,1,1]=4 330 B6R0.3 C[C@@H]([C@H](CO)N)O TS33038 [0,1,0,0,0,0|1,1,0]=3 331 B6R0.3 C[C@H](C(=O)N)OC TS31644 [0,1,0,0,0,0|1,1,1]=4 332 B6R0.3 C[C@H](C(=O)OC)F TS31728 [0,1,0,0,0,0|1,1,1]=4 333 B6R0.3 C[C@H](C(=O)OC)N TS01765 [0,1,0,0,0,0|1,1,1]=4 334 B6R0.3 C[C@H](C(=O)OC)O TS04018 [0,1,0,0,0,0|1,1,1]=4 335 B6R0.3 C[C@H](CCl)C(=O)Cl TS06547 [0,1,0,0,0,0|1,1,1]=4 336 B6R0.3 C[C@H](CO)C(=O)O TS31672 [0,1,0,0,0,0|1,1,1]=4 337 B6R0.3 C[C@H]([C@@H](CO)N)O TS07680 [0,1,0,0,0,0|1,1,0]=3 338 B6R0.7 CC(=C)C(C)(C)C TS03795 [0,1,0,0,0,0|1,0,1]=3 339 B6R0.7 CC(=C)C(C)(C)O TS03861 [0,1,0,0,0,0|1,0,1]=3 340 B6R0.7 CC(=O)C(C)(C)C TS00117 [0,1,0,0,0,0|0,1,1]=3 341 B6R0.7 CC(=O)C(C)(C)Cl TS32448 [0,1,0,0,0,0|0,1,1]=3 342 B6R0.7 CC(=O)C(C)(C)O TS31591 [0,1,0,0,0,0|0,1,1]=3 343 B6R0.7 CC(=O)[Si](C)(C)C TS04641 [0,1,0,0,0,0|0,2,1]=4 344 B6R0.7 CC(C(C)(Br)Br)Br TS35749 [0,1,0,0,0,0|2,0,0]=3 345 B6R0.7 CC(C(C)(C)Br)Br TS52923 [0,1,0,0,0,0|1,0,0]=2 346 B6R0.7 CC(C(C)(C)C)N TS31562 [0,1,0,0,0,0|1,0,0]=2 347 B6R0.7 CC(C(C)(C)C)O TS03960 [0,1,0,0,0,0|0,1,0]=2 348 B6R0.7 CC(C(Cl)(Cl)Cl)Cl TS14860 [0,1,0,0,0,0|3,0,0]=4 349 B6R0.7 CC(C(Cl)(Cl)Cl)O TS42645 [0,1,0,0,0,0|2,1,0]=4 350 B6R0.7 CC(C(F)(F)F)Br TS13946 [0,1,0,0,0,0|3,0,0]=4 351 B6R0.7 CC(C(F)(F)F)N TS08920 [0,1,0,0,0,0|3,0,0]=4 352 B6R0.7 CC(C(F)(F)F)N TS32001 [0,1,0,0,0,0|3,0,0]=4 353 B6R0.7 CC(C(F)(F)F)O TS04415 [0,1,0,0,0,0|2,1,0]=4 354 B6R0.7 CC(C(F)F)(F)F TS04567 [0,1,0,0,0,0|3,0,0]=4 355 B6R0.7 CC(C)(C(=O)Br)Br TS55080 [0,1,0,0,0,0|1,1,1]=4 356 B6R0.7 CC(C)(C(=O)Cl)Cl TS06549 [0,1,0,0,0,0|1,1,1]=4 357 B6R0.7 CC(C)(C(=O)N)Br TS42985 [0,1,0,0,0,0|1,1,1]=4 358 B6R0.7 CC(C)(C(=O)N)O TS03994 [0,1,0,0,0,0|1,1,1]=4 359 B6R0.7 CC(C)(C(=O)O)Br TS12333 [0,1,0,0,0,0|1,1,1]=4 360 B6R0.7 CC(C)(C(=O)O)F TS31729 [0,1,0,0,0,0|1,1,1]=4 361 B6R0.7 CC(C)(C(=O)O)N TS59938 [0,1,0,0,0,0|1,1,1]=4 362 B6R0.7 CC(C)(C(=O)O)O TS39665 [0,1,0,0,0,0|1,1,1]=4 363 B6R0.7 CC(C)(C(=O)O)S TS16701 [0,1,0,0,0,0|1,1,1]=4 364 B6R0.7 CC(C)(C(Cl)Cl)Cl TS11461 [0,1,0,0,0,0|2,0,0]=3 365 B6R0.7 CC(C)(C)C(=N)N TS03870 [0,1,0,0,0,0|2,0,1]=4 366 B6R0.7 CC(C)(C)C(=O)Cl TS39623 [0,1,0,0,0,0|1,1,1]=4 367 B6R0.7 CC(C)(C)C(=O)N TS03907 [0,1,0,0,0,0|1,1,1]=4 368 B6R0.7 CC(C)(C)C(=O)O TS59813 [0,1,0,0,0,0|1,1,1]=4 369 B6R0.7 CC(C)(C)C(=O)[O-] TS37551 [0,1,0,0,0,0|1,1,1]=4 370 B6R0.7 CC(C)(C)C(=O)[O-] TS93485 [0,1,0,0,0,0|1,1,1]=4 371 B6R0.7 CC(C)(C)C(=S)O TS32363 [0,1,0,0,0,0|1,0,2]=4 372 B6R0.7 CC(C)(C)C(Cl)Cl TS06552 [0,1,0,0,0,0|2,0,0]=3 373 B6R0.7 CC(C)(C)P(Cl)Cl TS42013 [0,1,0,0,0,0|3,0,0]=4 374 B6R0.7 CC(C)(C)S(=O)C TS32434 [0,1,0,0,0,0|1,1,0]=3 375 B6R0.7 CC(C)(C)S(=O)Cl TS37461 [0,1,0,0,0,0|2,1,0]=4 376 B6R0.7 CC(C)(C)S(=O)N TS08099 [0,1,0,0,0,0|2,1,0]=4 377 B6R0.7 CC(C)(C)S(=O)N TS46581 [0,1,0,0,0,0|2,1,0]=4 378 B6R0.7 CC(C)(C)S(=O)N TS46677 [0,1,0,0,0,0|2,1,0]=4 379 B6R0.7 CC(C)(C)[N+](=O)[O-] TS31639 [0,1,0,0,0,0|2,1,0]=4 380 B6R0.7 CC(C)(C)[S@](=S)[O-] TS37235 [0,1,0,0,0,0|2,0,1]=4 381 B6R0.7 CC(C)(C)[SiH](C)C TS04644 [0,1,0,0,0,0|1,1,0]=3 382 B6R0.7 CC(C)(C)[SiH](Cl)Cl TS41737 [0,1,0,0,0,0|2,1,0]=4 383 B6R0.7 CC(C)(N)N(C)C TS03979 [0,1,0,0,0,0|2,0,0]=3 384 B6R0.7 CC(C)([N+](=O)[O-])Br TS43298 [0,1,0,0,0,0|2,1,0]=4 385 B6R0.7 CC(C)([N+](=O)[O-])Cl TS04988 [0,1,0,0,0,0|2,1,0]=4 386 B6R0.7 CC(C)C(C)(C)C TS03880 [0,1,0,0,0,0|1,0,0]=2 387 B6R0.7 CC(C)C(C)(C)Cl TS04840 [0,1,0,0,0,0|1,0,0]=2 388 B6R0.7 CC(C)C(C)(C)O TS31618 [0,1,0,0,0,0|0,1,0]=2 389 B6R0.7 CC(C)C(C)(C)S TS32369 [0,1,0,0,0,0|0,0,0]=1 390 B6R0.7 CC(C)P(=O)(Cl)Cl TS11346 [0,1,0,0,0,0|2,1,0]=4 391 B6R0.7 CC(C)P(=O)(O)O TS05004 [0,1,0,0,0,0|2,1,0]=4 392 B6R0.7 CC(C)S(=O)(=O)Cl TS06809 [0,1,0,0,0,0|2,1,0]=4 393 B6R0.7 CC(C)S(=O)(=O)N TS32583 [0,1,0,0,0,0|2,1,0]=4 394 B6R0.7 CC(C)S(=O)(=O)[O-] TS07156 [0,1,0,0,0,0|2,1,0]=4 395 B6R0.7 CC(C)[Si](C)(Cl)Cl TS41740 [0,1,0,0,0,0|1,1,0]=3 396 B6R0.7 CC(C)[Si](Cl)(Cl)Cl TS46346 [0,1,0,0,0,0|2,1,0]=4 397 B6R0.7 CC([Si](C)(C)C)Cl TS06148 [0,1,0,0,0,0|1,1,0]=3 398 B6R0.7 CN(C)S(=O)(=O)C TS32581 [0,1,0,0,0,0|2,1,0]=4 399 B6R0.7 CN(C)[Ge](C)(C)C TS42369 [0,1,0,0,0,0|2,1,0]=4 400 B6R0.7 CN(C)[Si](C)(C)C TS32305 [0,1,0,0,0,0|2,1,0]=4 401 B6R0.7 CN(C)[Si](C)(C)Cl TS37147 [0,1,0,0,0,0|2,1,0]=4 402 B6R0.7 CN(C)[Sn](C)(C)C TS20467 [0,1,0,0,0,0|3,0,0]=4 403 B6R0.7 C[C@@H](C(C)(C)C)N TS31563 [0,1,0,0,0,0|1,0,0]=2 404 B6R0.7 C[C@@H](C(F)(F)F)N TS40792 [0,1,0,0,0,0|3,0,0]=4 405 B6R0.7 C[C@@H](C(F)(F)F)O TS04418 [0,1,0,0,0,0|2,1,0]=4 406 B6R0.7 C[C@H](C(C)(C)C)N TS03918 [0,1,0,0,0,0|1,0,0]=2 407 B6R0.7 C[C@H](C(F)(F)F)N TS08061 [0,1,0,0,0,0|3,0,0]=4 408 B6R0.7 C[C@H](C(F)(F)F)O TS04417 [0,1,0,0,0,0|2,1,0]=4 409 B6R0.7 C[Ge](C)(C)C(Cl)Cl TS38162 [0,1,0,0,0,0|2,1,0]=4 410 B6R0.7 C[Si](C)(C(Cl)Cl)Cl TS46345 [0,1,0,0,0,0|2,1,0]=4 411 B6R0.7 C[Si](C)(C)C(Cl)Cl TS41739 [0,1,0,0,0,0|2,1,0]=4 412 B6R1.4 CC1C(CN1)O TS92907 [0,0,0,1,0,0|1,1,0]=3 413 B6R1.9 C1C(C1(F)F)N TS32769 [0,0,0,1,0,0|3,0,0]=4 414 B6R1.9 CC1C(O1)(C)C TS71757 [0,0,0,1,0,0|0,1,0]=2 415 B6R1.9 CC1CC1(C)C TS71716 [0,0,0,1,0,0|1,0,0]=2 416 B6R1.11 B(C1CC1)(O)O TS55838 [0,0,0,1,0,0|2,1,0]=4 417 B6R1.11 C1CC1C(=N)N TS03501 [0,0,0,1,0,0|2,0,1]=4 418 B6R1.11 C1CC1C(=N)N TS04839 [0,0,0,1,0,0|2,0,1]=4 419 B6R1.11 C1CC1C(=O)Cl TS22948 [0,0,0,1,0,0|1,1,1]=4 420 B6R1.11 C1CC1C(=O)N TS55831 [0,0,0,1,0,0|1,1,1]=4 421 B6R1.11 C1CC1C(=O)O TS55832 [0,0,0,1,0,0|1,1,1]=4 422 B6R1.11 C1CC1C(=S)N TS94892 [0,0,0,1,0,0|1,0,2]=4 423 B6R1.11 CC(=O)C1CC1 TS39597 [0,0,0,1,0,0|0,1,1]=3 424 B6R1.11 CC(=O)C1CO1 TS03532 [0,0,0,1,0,0|1,1,1]=4 425 B6R1.11 CC(=O)N1CC1 TS03506 [0,0,0,1,0,0|1,1,1]=4 426 B6R1.11 CC(C)C1CC1 TS71711 [0,0,0,1,0,0|1,0,0]=2 427 B6R1.11 C[C@@H](C1CC1)N TS03514 [0,0,0,1,0,0|1,0,0]=2 428 B6R1.11 C[C@H](C1CC1)N TS03515 [0,0,0,1,0,0|1,0,0]=2 429 B6R0.2 B(CC(C)C)(O)O TS01505 [0,0,0,0,0,1|2,1,0]=4 430 B6R0.2 CC(=CC(=C)C)C TS03733 [0,0,0,0,0,1|1,0,2]=4 431 B6R0.2 CC(=CC(=O)C)C TS31432 [0,0,0,0,0,1|0,1,2]=4 432 B6R0.2 CC(=NN(C)C)C TS03874 [0,0,0,0,0,1|2,0,1]=4 433 B6R0.2 CC(=O)CN(C)C TS31555 [0,0,0,0,0,1|1,1,1]=4 434 B6R0.2 CC(C)CC(=C)C TS31451 [0,0,0,0,0,1|1,0,1]=3 435 B6R0.2 CC(C)CC(=O)C TS31526 [0,0,0,0,0,1|0,1,1]=3 436 B6R0.2 CC(C)CC(=O)Cl TS32446 [0,0,0,0,0,1|1,1,1]=4 437 B6R0.2 CC(C)CC(=O)N TS31557 [0,0,0,0,0,1|1,1,1]=4 438 B6R0.2 CC(C)CC(=O)O TS03936 [0,0,0,0,0,1|1,1,1]=4 439 B6R0.2 CC(C)CC(=O)[O-] TS32589 [0,0,0,0,0,1|1,1,1]=4 440 B6R0.2 CC(C)CC(C)Br TS42854 [0,0,0,0,0,1|1,0,0]=2 441 B6R0.2 CC(C)CC(C)C TS03884 [0,0,0,0,0,1|1,0,0]=2 442 B6R0.2 CC(C)CC(C)Cl TS04844 [0,0,0,0,0,1|1,0,0]=2 443 B6R0.2 CC(C)CC(C)N TS31566 [0,0,0,0,0,1|1,0,0]=2 444 B6R0.2 CC(C)CC(C)N TS94386 [0,0,0,0,0,1|1,0,0]=2 445 B6R0.2 CC(C)CC(C)O TS31610 [0,0,0,0,0,1|0,1,0]=2 446 B6R0.2 CC(C)CN(C)C TS03921 [0,0,0,0,0,1|2,0,0]=3 447 B6R0.2 CC(C)NC(=O)N TS31602 [0,0,0,0,0,1|1,1,1]=4 448 B6R0.2 CC(C)NC(C)C TS37146 [0,0,0,0,0,1|1,0,0]=2 449 B6R0.2 CC(C)NC(C)C TS37509 [0,0,0,0,0,1|1,0,0]=2 450 B6R0.2 CC(C)NC(C)C TS39848 [0,0,0,0,0,1|1,0,0]=2 451 B6R0.2 CC(C)NC(C)C TS52959 [0,0,0,0,0,1|1,0,0]=2 452 B6R0.2 CC(C)OC(=O)C TS01509 [0,0,0,0,0,1|0,1,1]=3 453 B6R0.2 CC(C)OC(=O)Cl TS59649 [0,0,0,0,0,1|1,1,1]=4 454 B6R0.2 CC(C)OC(=O)N TS03993 [0,0,0,0,0,1|1,1,1]=4 455 B6R0.2 CC(C)OC(C)C TS39676 [0,0,0,0,0,1|1,0,0]=2 456 B6R0.2 CC(C)O[Al](C)C TS04573 [0,0,0,0,0,1|2,0,0]=3 457 B6R0.2 CC(C)O[N+](=O)[O-] TS04064 [0,0,0,0,0,1|2,1,0]=4 458 B6R0.2 CC(C)PC(C)C TS04732 [0,0,0,0,0,1|1,0,0]=2 459 B6R0.2 CC(C)SC(C)C TS04751 [0,0,0,0,0,1|1,0,0]=2 460 B6R0.2 CC(C)[Hg]C(C)C TS35001 [0,0,0,0,0,1|1,0,0]=2 461 B6R0.2 CC(C)[N-]C(C)C TS74519 [0,0,0,0,0,1|1,0,0]=2 462 B6R0.2 CC(C)[SiH2]C(C)C TS04646 [0,0,0,0,0,1|1,0,0]=2 463 B6R0.2 CC(C=C(C)C)O TS03862 [0,0,0,0,0,1|0,1,1]=3 464 B6R0.2 CC(CC(=C)C)O TS31505 [0,0,0,0,0,1|0,1,2]=4 465 B6R0.2 CC(CC(C)Cl)Cl TS06556 [0,0,0,0,0,1|2,0,0]=3 466 B6R0.2 CC(CC(C)O)O TS04029 [0,0,0,0,0,1|1,1,0]=3 467 B6R0.2 CC(CN(C)C)Cl TS41840 [0,0,0,0,0,1|2,0,0]=3 468 B6R0.2 CC(CN(C)C)O TS04008 [0,0,0,0,0,1|1,1,0]=3 469 B6R0.2 CN(C)CN(C)C TS03971 [0,0,0,0,0,1|3,0,0]=4 470 B6R0.2 CP(C)CP(C)C TS36968 [0,0,0,0,0,1|3,0,0]=4 471 B6R0.2 C[C@@H](CN(C)C)O TS04004 [0,0,0,0,0,1|1,1,0]=3 472 B6R0.2 C[C@@H](C[C@H](C)O)O TS04035 [0,0,0,0,0,1|1,1,0]=3 473 B6R0.2 C[C@H](C[C@@H](C)O)O TS04043 [0,0,0,0,0,1|1,1,0]=3 474 B6R0.2 C[SiH](C)N[SiH](C)C TS36791 [0,0,0,0,0,1|1,2,0]=4 475 B6R0.2 C[SiH](C)O[SiH](C)C TS05934 [0,0,0,0,0,1|1,2,0]=4 476 B3R0.1 C(CBr)Br TS59882 [2,0,0,0,0,0|2,0,0]=4 477 B3R0.1 C(CBr)Cl TS00022 [2,0,0,0,0,0|2,0,0]=4 478 B3R0.1 C(CBr)F TS46917 [2,0,0,0,0,0|2,0,0]=4 479 B3R0.1 C(CBr)N TS11328 [2,0,0,0,0,0|2,0,0]=4 480 B3R0.1 C(CBr)N TS55165 [2,0,0,0,0,0|2,0,0]=4 481 B3R0.1 C(CBr)O TS55163 [2,0,0,0,0,0|1,1,0]=4 482 B3R0.1 C(CCl)Cl TS31460 [2,0,0,0,0,0|2,0,0]=4 483 B3R0.1 C(CCl)F TS71692 [2,0,0,0,0,0|2,0,0]=4 484 B3R0.1 C(CCl)N TS55277 [2,0,0,0,0,0|2,0,0]=4 485 B3R0.1 C(CCl)O TS00074 [2,0,0,0,0,0|1,1,0]=4 486 B3R0.1 C(CCl)[SiH3] TS31360 [2,0,0,0,0,0|1,1,0]=4 487 B3R0.1 C(CF)F TS02711 [2,0,0,0,0,0|2,0,0]=4 488 B3R0.1 C(CF)N TS31476 [2,0,0,0,0,0|2,0,0]=4 489 B3R0.1 C(CF)O TS01026 [2,0,0,0,0,0|1,1,0]=4 490 B3R0.1 C(CI)Cl TS51200 [2,0,0,0,0,0|2,0,0]=4 491 B3R0.1 C(CI)F TS45712 [2,0,0,0,0,0|2,0,0]=4 492 B3R0.1 C(CI)I TS93956 [2,0,0,0,0,0|2,0,0]=4 493 B3R0.1 C(CI)O TS13090 [2,0,0,0,0,0|1,1,0]=4 494 B3R0.1 C(CN)N TS03440 [2,0,0,0,0,0|2,0,0]=4 495 B3R0.1 C(CN)N TS03650 [2,0,0,0,0,0|2,0,0]=4 496 B3R0.1 C(CN)N TS05804 [2,0,0,0,0,0|2,0,0]=4 497 B3R0.1 C(CN)N TS22305 [2,0,0,0,0,0|2,0,0]=4 498 B3R0.1 C(CN)N TS26096 [2,0,0,0,0,0|2,0,0]=4 499 B3R0.1 C(CN)N TS65589 [2,0,0,0,0,0|2,0,0]=4 500 B3R0.1 C(CN)N TS70395 [2,0,0,0,0,0|2,0,0]=4 501 B3R0.1 C(CN)N TS76811 [2,0,0,0,0,0|2,0,0]=4 502 B3R0.1 C(CN)N TS79362 [2,0,0,0,0,0|2,0,0]=4 503 B3R0.1 C(CN)[NH3+] TS03740 [2,0,0,0,0,0|2,0,0]=4 504 B3R0.1 C(CO)N TS08649 [2,0,0,0,0,0|1,1,0]=4 505 B3R0.1 C(CO)N TS31412 [2,0,0,0,0,0|1,1,0]=4 506 B3R0.1 C(CO)N TS31567 [2,0,0,0,0,0|1,1,0]=4 507 B3R0.1 C(CO)N TS93285 [2,0,0,0,0,0|1,1,0]=4 508 B3R0.1 C(CO)O TS02439 [2,0,0,0,0,0|1,1,0]=4 509 B3R0.1 C(CP)O TS03426 [2,0,0,0,0,0|1,1,0]=4 510 B3R0.1 C(CP)P TS03658 [2,0,0,0,0,0|2,0,0]=4 511 B3R0.1 C(CS)N TS03420 [2,0,0,0,0,0|1,0,0]=3 512 B3R0.1 C(CS)N TS39644 [2,0,0,0,0,0|1,0,0]=3 513 B3R0.1 C(CS)O TS71649 [2,0,0,0,0,0|1,0,0]=3 514 B3R0.1 C(CS)S TS74490 [2,0,0,0,0,0|1,0,0]=3 515 B3R0.1 C(C[O-])O TS70846 [2,0,0,0,0,0|1,1,0]=4 516 B3R0.1 C(C[SiH3])[SiH3] TS03631 [2,0,0,0,0,0|0,2,0]=4 517 B3R0.1 C=CCS TS71619 [2,0,0,0,0,0|0,0,2]=4 518 B3R0.1 CCC#C TS65570 [2,0,0,0,0,0|0,0,2]=4 519 B3R0.1 CCC#N TS65577 [2,0,0,0,0,0|1,0,1]=4 520 B3R0.1 CCC=C TS02407 [2,0,0,0,0,0|0,0,2]=4 521 B3R0.1 CCC=O TS02416 [2,0,0,0,0,0|0,1,1]=4 522 B3R0.1 CCC=S TS71851 [2,0,0,0,0,0|0,0,2]=4 523 B3R0.1 CCCBr TS00040 [2,0,0,0,0,0|1,0,0]=3 524 B3R0.1 CCCCl TS71653 [2,0,0,0,0,0|1,0,0]=3 525 B3R0.1 CCCF TS65692 [2,0,0,0,0,0|1,0,0]=3 526 B3R0.1 CCCI TS45076 [2,0,0,0,0,0|1,0,0]=3 527 B3R0.1 CCCN TS02429 [2,0,0,0,0,0|1,0,0]=3 528 B3R0.1 CCCN TS03705 [2,0,0,0,0,0|1,0,0]=3 529 B3R0.1 CCCS TS03410 [2,0,0,0,0,0|0,0,0]=2 530 B3R0.1 CCC[O-] TS03458 [2,0,0,0,0,0|0,1,0]=3 531 B3R0.1 CCC[O-] TS37676 [2,0,0,0,0,0|0,1,0]=3 532 B3R0.1 CCC[O-] TS56091 [2,0,0,0,0,0|0,1,0]=3 533 B3R0.1 CCC[S-] TS03782 [2,0,0,0,0,0|0,0,1]=3 534 B3R0.1 CCNC TS03706 [2,0,0,0,0,0|1,0,0]=3 535 B3R0.1 CCNC TS16623 [2,0,0,0,0,0|1,0,0]=3 536 B3R0.1 CCNO TS64941 [2,0,0,0,0,0|1,1,0]=4 537 B3R0.1 CCOC TS65588 [2,0,0,0,0,0|1,0,0]=3 538 B3R0.1 CCON TS31411 [2,0,0,0,0,0|2,0,0]=4 539 B3R0.1 CCSC TS71648 [2,0,0,0,0,0|1,0,0]=3 540 B3R0.1 CC[Hg]Cl TS30124 [2,0,0,0,0,0|2,0,0]=4 541 B3R0.1 CC[Mg]Br TS36790 [2,0,0,0,0,0|2,0,0]=4 542 B3R0.1 CC[Mg]I TS93021 [2,0,0,0,0,0|2,0,0]=4 543 B3R0.1 CNNC TS05803 [2,0,0,0,0,0|2,0,0]=4 544 B3R0.1 CNNC TS65590 [2,0,0,0,0,0|2,0,0]=4 545 B3R0.1 CNOC TS01578 [2,0,0,0,0,0|2,0,0]=4 546 B3R0.1 COCBr TS36040 [2,0,0,0,0,0|2,0,0]=4 547 B3R0.1 COCCl TS56228 [2,0,0,0,0,0|2,0,0]=4 548 B3R0.1 COCI TS13091 [2,0,0,0,0,0|2,0,0]=4 549 B3R0.1 CSSC TS34583 [2,0,0,0,0,0|2,0,0]=4 550 B3R0.1 C[Se][Se]C TS15888 [2,0,0,0,0,0|2,0,0]=4 551 B3R0.1 C[SiH2]C[SiH3] TS03630 [2,0,0,0,0,0|0,2,0]=4 552 B3R0.2 B(C)(C)C TS02403 [2,0,0,0,0,0|1,0,0]=3 553 B3R0.2 CC(=C)C TS02408 [2,0,0,0,0,0|0,0,2]=4 554 B3R0.2 CC(=C)C TS12599 [2,0,0,0,0,0|0,0,2]=4 555 B3R0.2 CC(=O)C TS02420 [2,0,0,0,0,0|0,1,1]=4 556 B3R0.2 CC(=O)C TS42396 [2,0,0,0,0,0|0,1,1]=4 557 B3R0.2 CC(Br)Br TS15883 [2,0,0,0,0,0|2,0,0]=4 558 B3R0.2 CC(C)Br TS00860 [2,0,0,0,0,0|1,0,0]=3 559 B3R0.2 CC(C)C TS02421 [2,0,0,0,0,0|0,0,0]=2 560 B3R0.2 CC(C)Cl TS00076 [2,0,0,0,0,0|1,0,0]=3 561 B3R0.2 CC(C)F TS02440 [2,0,0,0,0,0|1,0,0]=3 562 B3R0.2 CC(C)N TS01924 [2,0,0,0,0,0|1,0,0]=3 563 B3R0.2 CC(C)O TS65587 [2,0,0,0,0,0|0,1,0]=3 564 B3R0.2 CC(C)S TS03409 [2,0,0,0,0,0|0,0,0]=2 565 B3R0.2 CC(C)[O-] TS00285 [2,0,0,0,0,0|0,1,0]=3 566 B3R0.2 CC(C)[O-] TS01956 [2,0,0,0,0,0|0,1,0]=3 567 B3R0.2 CC(C)[O-] TS03787 [2,0,0,0,0,0|0,1,0]=3 568 B3R0.2 CC(C)[O-] TS11045 [2,0,0,0,0,0|0,1,0]=3 569 B3R0.2 CC(C)[O-] TS24723 [2,0,0,0,0,0|0,1,0]=3 570 B3R0.2 CC(C)[O-] TS25988 [2,0,0,0,0,0|0,1,0]=3 571 B3R0.2 CC(C)[O-] TS29590 [2,0,0,0,0,0|0,1,0]=3 572 B3R0.2 CC(C)[O-] TS50088 [2,0,0,0,0,0|0,1,0]=3 573 B3R0.2 CC(C)[O-] TS56090 [2,0,0,0,0,0|0,1,0]=3 574 B3R0.2 CC(C)[O-] TS57337 [2,0,0,0,0,0|0,1,0]=3 575 B3R0.2 CC(C)[O-] TS60765 [2,0,0,0,0,0|0,1,0]=3 576 B3R0.2 CC(C)[O-] TS61265 [2,0,0,0,0,0|0,1,0]=3 577 B3R0.2 CC(C)[O-] TS61382 [2,0,0,0,0,0|0,1,0]=3 578 B3R0.2 CC(C)[O-] TS62375 [2,0,0,0,0,0|0,1,0]=3 579 B3R0.2 CC(C)[O-] TS63485 [2,0,0,0,0,0|0,1,0]=3 580 B3R0.2 CC(C)[O-] TS63487 [2,0,0,0,0,0|0,1,0]=3 581 B3R0.2 CC(C)[O-] TS63938 [2,0,0,0,0,0|0,1,0]=3 582 B3R0.2 CC(C)[O-] TS66142 [2,0,0,0,0,0|0,1,0]=3 583 B3R0.2 CC(C)[O-] TS67052 [2,0,0,0,0,0|0,1,0]=3 584 B3R0.2 CC(C)[O-] TS72330 [2,0,0,0,0,0|0,1,0]=3 585 B3R0.2 CC(C)[O-] TS77323 [2,0,0,0,0,0|0,1,0]=3 586 B3R0.2 CC(C)[O-] TS78714 [2,0,0,0,0,0|0,1,0]=3 587 B3R0.2 CC(C)[O-] TS79015 [2,0,0,0,0,0|0,1,0]=3 588 B3R0.2 CC(C)[O-] TS79109 [2,0,0,0,0,0|0,1,0]=3 589 B3R0.2 CC(C)[S-] TS03781 [2,0,0,0,0,0|0,0,1]=3 590 B3R0.2 CC(Cl)Br TS06900 [2,0,0,0,0,0|2,0,0]=4 591 B3R0.2 CC(Cl)Cl TS31461 [2,0,0,0,0,0|2,0,0]=4 592 B3R0.2 CC(F)Cl TS71693 [2,0,0,0,0,0|2,0,0]=4 593 B3R0.2 CC(F)F TS02706 [2,0,0,0,0,0|2,0,0]=4 594 B3R0.2 CN(C)C TS02428 [2,0,0,0,0,0|1,0,0]=3 595 B3R0.2 CN(C)C TS03598 [2,0,0,0,0,0|1,0,0]=3 596 B3R0.2 CN(C)C TS04077 [2,0,0,0,0,0|1,0,0]=3 597 B3R0.2 CN(C)C TS37301 [2,0,0,0,0,0|1,0,0]=3 598 B3R0.2 CN(C)N TS03741 [2,0,0,0,0,0|2,0,0]=4 599 B3R0.2 CN(C)N TS34594 [2,0,0,0,0,0|2,0,0]=4 600 B3R0.2 CN(C)O TS31413 [2,0,0,0,0,0|1,1,0]=4 601 B3R0.2 CP(C)C TS71641 [2,0,0,0,0,0|1,0,0]=3 602 B3R0.2 CP(C)C TS76280 [2,0,0,0,0,0|1,0,0]=3 603 B3R0.2 CP(C)Cl TS03739 [2,0,0,0,0,0|2,0,0]=4 604 B3R0.2 C[Al](C)C TS71595 [2,0,0,0,0,0|1,0,0]=3 605 B3R0.2 C[As](C)C TS32403 [2,0,0,0,0,0|1,0,0]=3 606 B3R0.2 C[As](C)I TS25149 [2,0,0,0,0,0|2,0,0]=4 607 B3R0.2 C[Bi](C)C TS28559 [2,0,0,0,0,0|1,0,0]=3 608 B3R0.2 C[Ga](C)C TS32132 [2,0,0,0,0,0|1,0,0]=3 609 B3R0.2 C[GeH](C)C TS04775 [2,0,0,0,0,0|0,1,0]=3 610 B3R0.2 C[In](C)C TS11202 [2,0,0,0,0,0|1,0,0]=3 611 B3R0.2 C[N+](=C)C TS15411 [2,0,0,0,0,0|1,0,1]=4 612 B3R0.2 C[S+](C)C TS10818 [2,0,0,0,0,0|1,0,0]=3 613 B3R0.2 C[S+](C)C TS59468 [2,0,0,0,0,0|1,0,0]=3 614 B3R0.2 C[Sb](C)C TS43174 [2,0,0,0,0,0|1,0,0]=3 615 B3R0.2 C[SiH](C)C TS71620 [2,0,0,0,0,0|0,1,0]=3 616 B3R0.2 C[SiH](C)Cl TS31361 [2,0,0,0,0,0|1,1,0]=4 617 B3R0.2 C[SiH](C)F TS71650 [2,0,0,0,0,0|1,1,0]=4 618 B3R0.2 C[Sn+](C)C TS59840 [2,0,0,0,0,0|1,0,0]=3 619 B3R0.2 C[Sn](=O)C TS42834 [2,0,0,0,0,0|1,1,0]=4 620 B3R0.2 C[Sn](=S)C TS14707 [2,0,0,0,0,0|1,0,1]=4 621 B5R0.1 CC#CC(C)C TS71688 [1,1,0,0,0,0|0,0,1]=3 622 B5R0.1 CC#C[C@H](C)O TS03495 [1,1,0,0,0,0|0,1,1]=4 623 B5R0.1 CC(=C)CCO TS71766 [1,1,0,0,0,0|0,0,2]=4 624 B5R0.1 CC(=CCBr)C TS00408 [1,1,0,0,0,0|0,0,2]=4 625 B5R0.1 CC(=CCCl)C TS00047 [1,1,0,0,0,0|0,0,2]=4 626 B5R0.1 CC(=CCN)C TS04881 [1,1,0,0,0,0|0,0,2]=4 627 B5R0.1 CC(=CCN)C TS63606 [1,1,0,0,0,0|0,0,2]=4 628 B5R0.1 CC(=CCN)C TS70656 [1,1,0,0,0,0|0,0,2]=4 629 B5R0.1 CC(=CCO)C TS71763 [1,1,0,0,0,0|0,0,2]=4 630 B5R0.1 CC(=CCS)C TS03985 [1,1,0,0,0,0|0,0,1]=3 631 B5R0.1 CC(=O)CCO TS39752 [1,1,0,0,0,0|0,1,1]=4 632 B5R0.1 CC(=O)CCS TS31678 [1,1,0,0,0,0|0,1,1]=4 633 B5R0.1 CC(=O)COC TS03573 [1,1,0,0,0,0|0,1,1]=4 634 B5R0.1 CC(=O)CSC TS31685 [1,1,0,0,0,0|0,1,1]=4 635 B5R0.1 CC(C)CC#C TS03469 [1,1,0,0,0,0|0,0,1]=3 636 B5R0.1 CC(C)CC#N TS71700 [1,1,0,0,0,0|0,0,1]=3 637 B5R0.1 CC(C)CC=O TS71746 [1,1,0,0,0,0|0,0,1]=3 638 B5R0.1 CC(C)CCBr TS09985 [1,1,0,0,0,0|0,0,0]=2 639 B5R0.1 CC(C)CCCl TS31743 [1,1,0,0,0,0|0,0,0]=2 640 B5R0.1 CC(C)CCI TS18548 [1,1,0,0,0,0|0,0,0]=2 641 B5R0.1 CC(C)CCN TS71773 [1,1,0,0,0,0|0,0,0]=2 642 B5R0.1 CC(C)CCO TS71804 [1,1,0,0,0,0|0,0,0]=2 643 B5R0.1 CC(C)CCS TS31696 [1,1,0,0,0,0|0,0,0]=2 644 B5R0.1 CC(C)CC[Zn+] TS49167 [1,1,0,0,0,0|0,0,0]=2 645 B5R0.1 CC(C)CNC TS01600 [1,1,0,0,0,0|0,0,0]=2 646 B5R0.1 CC(C)CNN TS04103 [1,1,0,0,0,0|1,0,0]=3 647 B5R0.1 CC(C)CON TS36090 [1,1,0,0,0,0|0,1,0]=3 648 B5R0.1 CC(C)CSC TS31693 [1,1,0,0,0,0|0,0,0]=2 649 B5R0.1 CC(C)N=C=O TS71736 [1,1,0,0,0,0|0,1,1]=4 650 B5R0.1 CC(C)N=C=S TS03909 [1,1,0,0,0,0|0,0,2]=4 651 B5R0.1 CC(C)OC=C TS03534 [1,1,0,0,0,0|0,0,2]=4 652 B5R0.1 CC(C)OC=O TS03580 [1,1,0,0,0,0|0,1,1]=4 653 B5R0.1 CC(C)OCCl TS04160 [1,1,0,0,0,0|1,0,0]=3 654 B5R0.1 CC(C)ON=O TS71823 [1,1,0,0,0,0|1,1,0]=4 655 B5R0.1 CC(C)SC#N TS03914 [1,1,0,0,0,0|1,0,1]=4 656 B5R0.1 CC(CC#C)O TS03487 [1,1,0,0,0,0|0,1,1]=4 657 B5R0.1 CC(CC#N)Br TS40583 [1,1,0,0,0,0|1,0,1]=4 658 B5R0.1 CC(CC=C)O TS71743 [1,1,0,0,0,0|0,1,1]=4 659 B5R0.1 CC(CC=O)O TS03574 [1,1,0,0,0,0|0,1,1]=4 660 B5R0.1 CC(CCBr)Br TS21967 [1,1,0,0,0,0|1,0,0]=3 661 B5R0.1 CC(CCN)O TS02231 [1,1,0,0,0,0|0,1,0]=3 662 B5R0.1 CC(CCO)N TS60329 [1,1,0,0,0,0|1,0,0]=3 663 B5R0.1 CC(CCO)O TS71832 [1,1,0,0,0,0|0,1,0]=3 664 B5R0.1 CC(CCS)S TS04931 [1,1,0,0,0,0|0,0,0]=2 665 B5R0.1 CC(COC)N TS03608 [1,1,0,0,0,0|1,0,0]=3 666 B5R0.1 CC(COC)O TS71841 [1,1,0,0,0,0|0,1,0]=3 667 B5R0.1 CC=CC(C)C TS71719 [1,1,0,0,0,0|0,0,1]=3 668 B5R0.1 CC=CC(C)O TS71747 [1,1,0,0,0,0|0,1,1]=4 669 B5R0.1 CCC=C(C)C TS71718 [1,1,0,0,0,0|0,0,1]=3 670 B5R0.1 CCCC(=C)C TS71722 [1,1,0,0,0,0|0,0,2]=4 671 B5R0.1 CCCC(=O)C TS71754 [1,1,0,0,0,0|0,1,1]=4 672 B5R0.1 CCCC(C)Br TS09989 [1,1,0,0,0,0|1,0,0]=3 673 B5R0.1 CCCC(C)Cl TS31741 [1,1,0,0,0,0|1,0,0]=3 674 B5R0.1 CCCC(C)I TS18550 [1,1,0,0,0,0|1,0,0]=3 675 B5R0.1 CCCC(C)O TS03596 [1,1,0,0,0,0|0,1,0]=3 676 B5R0.1 CCCC(C)S TS31692 [1,1,0,0,0,0|0,0,0]=2 677 B5R0.1 CCCC(C)[Zn+] TS49166 [1,1,0,0,0,0|1,0,0]=3 678 B5R0.1 CCCC(Cl)Cl TS36206 [1,1,0,0,0,0|2,0,0]=4 679 B5R0.1 CCCN(C)C TS71775 [1,1,0,0,0,0|1,0,0]=3 680 B5R0.1 CCC[C@@H](C)O TS71801 [1,1,0,0,0,0|0,1,0]=3 681 B5R0.1 CCC[C@H](C)O TS71800 [1,1,0,0,0,0|0,1,0]=3 682 B5R0.1 CCNC(=O)C TS03563 [1,1,0,0,0,0|0,1,1]=4 683 B5R0.1 CCNC(C)C TS71777 [1,1,0,0,0,0|0,0,0]=2 684 B5R0.1 CCOC(=C)C TS71753 [1,1,0,0,0,0|0,0,2]=4 685 B5R0.1 CCOC(=O)C TS03585 [1,1,0,0,0,0|0,1,1]=4 686 B5R0.1 CCOC(=O)C TS03625 [1,1,0,0,0,0|0,1,1]=4 687 B5R0.1 CCOC(=O)C TS71827 [1,1,0,0,0,0|0,1,1]=4 688 B5R0.1 CCOC(=S)C TS31684 [1,1,0,0,0,0|0,0,2]=4 689 B5R0.1 CCOC(C)C TS03595 [1,1,0,0,0,0|0,0,0]=2 690 B5R0.1 CCOC(C)Cl TS04164 [1,1,0,0,0,0|1,0,0]=3 691 B5R0.1 CCO[SiH](C)C TS04048 [1,1,0,0,0,0|0,1,0]=3 692 B5R0.1 CCSC(=S)C TS32440 [1,1,0,0,0,0|0,0,2]=4 693 B5R0.1 CCSC(C)C TS31689 [1,1,0,0,0,0|0,0,0]=2 694 B5R0.1 CN(C)CC#N TS01455 [1,1,0,0,0,0|1,0,1]=4 695 B5R0.1 CN(C)CC=C TS56352 [1,1,0,0,0,0|1,0,1]=4 696 B5R0.1 CN(C)CCBr TS25321 [1,1,0,0,0,0|1,0,0]=3 697 B5R0.1 CN(C)CCN TS00990 [1,1,0,0,0,0|1,0,0]=3 698 B5R0.1 CN(C)CCO TS03600 [1,1,0,0,0,0|1,0,0]=3 699 B5R0.1 CN(C)CCS TS31711 [1,1,0,0,0,0|1,0,0]=3 700 B5R0.1 CN(C)CCS TS37538 [1,1,0,0,0,0|1,0,0]=3 701 B5R0.1 CN(C)CCS TS37540 [1,1,0,0,0,0|1,0,0]=3 702 B5R0.1 CSCS(=O)C TS05065 [1,1,0,0,0,0|1,1,0]=4 703 B5R0.1 C[C@@H](CC#N)O TS71734 [1,1,0,0,0,0|0,1,1]=4 704 B5R0.1 C[C@@H](CCO)O TS71843 [1,1,0,0,0,0|0,1,0]=3 705 B5R0.1 C[C@@H](COC)N TS03602 [1,1,0,0,0,0|1,0,0]=3 706 B5R0.1 C[C@@H](COC)O TS71834 [1,1,0,0,0,0|0,1,0]=3 707 B5R0.1 C[C@H](CC#N)O TS03507 [1,1,0,0,0,0|0,1,1]=4 708 B5R0.1 C[C@H](CC=C)O TS03535 [1,1,0,0,0,0|0,1,1]=4 709 B5R0.1 C[C@H](CCO)N TS93947 [1,1,0,0,0,0|1,0,0]=3 710 B5R0.1 C[C@H](CCO)O TS71835 [1,1,0,0,0,0|0,1,0]=3 711 B5R0.1 C[C@H](COC)O TS00301 [1,1,0,0,0,0|0,1,0]=3 712 B5R0.1 C[S+](C)CC#C TS48036 [1,1,0,0,0,0|1,0,1]=4 713 B5R0.1 C[SiH](C)CC=C TS03888 [1,1,0,0,0,0|0,1,1]=4 714 B5R0.3 C(C(CBr)Br)Br TS54387 [1,1,0,0,0,0|2,0,0]=4 715 B5R0.3 C(C(CBr)Br)Cl TS25944 [1,1,0,0,0,0|2,0,0]=4 716 B5R0.3 C(C(CBr)Br)O TS22312 [1,1,0,0,0,0|1,1,0]=4 717 B5R0.3 C(C(CBr)O)Br TS22311 [1,1,0,0,0,0|1,1,0]=4 718 B5R0.3 C(C(CBr)O)F TS10809 [1,1,0,0,0,0|1,1,0]=4 719 B5R0.3 C(C(CBr)O)O TS10534 [1,1,0,0,0,0|1,1,0]=4 720 B5R0.3 C(C(CCl)Cl)Cl TS07383 [1,1,0,0,0,0|2,0,0]=4 721 B5R0.3 C(C(CCl)Cl)O TS36383 [1,1,0,0,0,0|1,1,0]=4 722 B5R0.3 C(C(CCl)O)Cl TS07880 [1,1,0,0,0,0|1,1,0]=4 723 B5R0.3 C(C(CCl)O)F TS31988 [1,1,0,0,0,0|1,1,0]=4 724 B5R0.3 C(C(CCl)O)O TS08669 [1,1,0,0,0,0|1,1,0]=4 725 B5R0.3 C(C(CF)Cl)F TS32129 [1,1,0,0,0,0|2,0,0]=4 726 B5R0.3 C(C(CF)O)F TS03710 [1,1,0,0,0,0|1,1,0]=4 727 B5R0.3 C(C(CN)O)N TS46792 [1,1,0,0,0,0|1,1,0]=4 728 B5R0.3 C(C(CO)N)O TS65262 [1,1,0,0,0,0|1,1,0]=4 729 B5R0.3 C(C(CO)N)O TS65263 [1,1,0,0,0,0|1,1,0]=4 730 B5R0.3 C(C(CO)N)O TS74211 [1,1,0,0,0,0|1,1,0]=4 731 B5R0.3 C(C(CO)O)N TS39698 [1,1,0,0,0,0|1,1,0]=4 732 B5R0.3 C(C(CO)O)O TS03653 [1,1,0,0,0,0|1,1,0]=4 733 B5R0.3 C(C(CO)O)O TS64624 [1,1,0,0,0,0|1,1,0]=4 734 B5R0.3 C(C(CO)O)O TS93602 [1,1,0,0,0,0|1,1,0]=4 735 B5R0.3 C(C(CS)O)O TS31781 [1,1,0,0,0,0|1,0,0]=3 736 B5R0.3 C(C(CS)S)O TS47162 [1,1,0,0,0,0|1,0,0]=3 737 B5R0.3 C([C@@H](CBr)O)O TS10532 [1,1,0,0,0,0|1,1,0]=4 738 B5R0.3 C([C@@H](CCl)O)N TS93716 [1,1,0,0,0,0|1,1,0]=4 739 B5R0.3 C([C@@H](CCl)O)O TS59492 [1,1,0,0,0,0|1,1,0]=4 740 B5R0.3 C([C@@H](CO)O)N TS05290 [1,1,0,0,0,0|1,1,0]=4 741 B5R0.3 C([C@@H](CO)O)N TS08134 [1,1,0,0,0,0|1,1,0]=4 742 B5R0.3 C([C@H](CBr)O)O TS10533 [1,1,0,0,0,0|1,1,0]=4 743 B5R0.3 C([C@H](CO)O)N TS08079 [1,1,0,0,0,0|1,1,0]=4 744 B5R0.3 CC(C#C)NC TS71701 [1,1,0,0,0,0|0,0,2]=4 745 B5R0.3 CC(CCl)CBr TS00026 [1,1,0,0,0,0|1,0,0]=3 746 B5R0.3 CC(CO)C=C TS71745 [1,1,0,0,0,0|0,0,2]=4 747 B5R0.3 CC(CO)CO TS71833 [1,1,0,0,0,0|0,1,0]=3 748 B5R0.3 CC(OC)OC TS71840 [1,1,0,0,0,0|1,0,0]=3 749 B5R0.3 CC([Se]C)[Se]C TS44785 [1,1,0,0,0,0|1,0,0]=3 750 B5R0.3 CCC(=C)CC TS71714 [1,1,0,0,0,0|0,0,2]=4 751 B5R0.3 CCC(=NO)C TS03558 [1,1,0,0,0,0|0,1,1]=4 752 B5R0.3 CCC(=O)CBr TS00020 [1,1,0,0,0,0|0,1,1]=4 753 B5R0.3 CCC(=O)CC TS00240 [1,1,0,0,0,0|0,1,1]=4 754 B5R0.3 CCC(=O)CCl TS31736 [1,1,0,0,0,0|0,1,1]=4 755 B5R0.3 CCC(=O)CO TS05538 [1,1,0,0,0,0|0,1,1]=4 756 B5R0.3 CCC(=O)NC TS03562 [1,1,0,0,0,0|0,1,1]=4 757 B5R0.3 CCC(=O)OC TS03587 [1,1,0,0,0,0|0,1,1]=4 758 B5R0.3 CCC(=S)OC TS31680 [1,1,0,0,0,0|0,0,2]=4 759 B5R0.3 CCC(C#C)O TS03494 [1,1,0,0,0,0|0,1,1]=4 760 B5R0.3 CCC(C#N)O TS03503 [1,1,0,0,0,0|0,1,1]=4 761 B5R0.3 CCC(C)C#C TS03468 [1,1,0,0,0,0|0,0,1]=3 762 B5R0.3 CCC(C)C=O TS03536 [1,1,0,0,0,0|0,0,1]=3 763 B5R0.3 CCC(C)CBr TS09987 [1,1,0,0,0,0|0,0,0]=2 764 B5R0.3 CCC(C)CC TS03546 [1,1,0,0,0,0|0,0,0]=2 765 B5R0.3 CCC(C)CCl TS31746 [1,1,0,0,0,0|0,0,0]=2 766 B5R0.3 CCC(C)CI TS18546 [1,1,0,0,0,0|0,0,0]=2 767 B5R0.3 CCC(C)CN TS71788 [1,1,0,0,0,0|0,0,0]=2 768 B5R0.3 CCC(C)CO TS03593 [1,1,0,0,0,0|0,0,0]=2 769 B5R0.3 CCC(C)CS TS31698 [1,1,0,0,0,0|0,0,0]=2 770 B5R0.3 CCC(C)NC TS04995 [1,1,0,0,0,0|0,0,0]=2 771 B5R0.3 CCC(C)NC TS71785 [1,1,0,0,0,0|0,0,0]=2 772 B5R0.3 CCC(C)OC TS71803 [1,1,0,0,0,0|0,0,0]=2 773 B5R0.3 CCC(C)ON TS36089 [1,1,0,0,0,0|0,1,0]=3 774 B5R0.3 CCC(C)SC TS31697 [1,1,0,0,0,0|0,0,0]=2 775 B5R0.3 CCC(C)[Mg]Br TS11456 [1,1,0,0,0,0|1,0,0]=3 776 B5R0.3 CCC(C)[Mg]Cl TS32262 [1,1,0,0,0,0|1,0,0]=3 777 B5R0.3 CCC(C=C)O TS71760 [1,1,0,0,0,0|0,1,1]=4 778 B5R0.3 CCC(CBr)Br TS21966 [1,1,0,0,0,0|1,0,0]=3 779 B5R0.3 CCC(CBr)Cl TS13062 [1,1,0,0,0,0|1,0,0]=3 780 B5R0.3 CCC(CBr)O TS10270 [1,1,0,0,0,0|0,1,0]=3 781 B5R0.3 CCC(CC)Br TS09988 [1,1,0,0,0,0|1,0,0]=3 782 B5R0.3 CCC(CC)Cl TS31745 [1,1,0,0,0,0|1,0,0]=3 783 B5R0.3 CCC(CC)F TS71849 [1,1,0,0,0,0|1,0,0]=3 784 B5R0.3 CCC(CC)I TS18549 [1,1,0,0,0,0|1,0,0]=3 785 B5R0.3 CCC(CC)N TS00440 [1,1,0,0,0,0|1,0,0]=3 786 B5R0.3 CCC(CC)O TS00239 [1,1,0,0,0,0|0,1,0]=3 787 B5R0.3 CCC(CC)[Zn+] TS49169 [1,1,0,0,0,0|1,0,0]=3 788 B5R0.3 CCC(CCl)Cl TS36203 [1,1,0,0,0,0|1,0,0]=3 789 B5R0.3 CCC(CN)N TS71807 [1,1,0,0,0,0|1,0,0]=3 790 B5R0.3 CCC(CN)O TS03604 [1,1,0,0,0,0|0,1,0]=3 791 B5R0.3 CCC(CO)N TS03601 [1,1,0,0,0,0|1,0,0]=3 792 B5R0.3 CCC(CS)S TS04932 [1,1,0,0,0,0|0,0,0]=2 793 B5R0.3 CCN(C)CC TS71781 [1,1,0,0,0,0|1,0,0]=3 794 B5R0.3 CCN(C)N=O TS03588 [1,1,0,0,0,0|1,1,0]=4 795 B5R0.3 CCN(CC)O TS03599 [1,1,0,0,0,0|1,1,0]=4 796 B5R0.3 CCP(CC)Cl TS36025 [1,1,0,0,0,0|2,0,0]=4 797 B5R0.3 CCS(=O)CC TS04104 [1,1,0,0,0,0|1,1,0]=4 798 B5R0.3 CC[Al](CC)Cl TS27650 [1,1,0,0,0,0|2,0,0]=4 799 B5R0.3 CC[C@@H](CO)O TS71836 [1,1,0,0,0,0|0,1,0]=3 800 B5R0.3 CC[C@H](C)C#N TS71705 [1,1,0,0,0,0|0,0,1]=3 801 B5R0.3 CC[C@H](C)CBr TS39655 [1,1,0,0,0,0|0,0,0]=2 802 B5R0.3 CC[C@H](C)CCl TS31744 [1,1,0,0,0,0|0,0,0]=2 803 B5R0.3 CC[C@H](CO)N TS03605 [1,1,0,0,0,0|1,0,0]=3 804 B5R0.3 CC[C@H](CO)O TS71838 [1,1,0,0,0,0|0,1,0]=3 805 B5R0.3 CC[SiH](C)CC TS03988 [1,1,0,0,0,0|0,1,0]=3 806 B5R0.3 CC[Sn](=O)CC TS17584 [1,1,0,0,0,0|1,1,0]=4 807 B5R0.3 COC(=O)CS TS39888 [1,1,0,0,0,0|1,0,1]=4 808 B5R0.3 CO[SiH](C)OC TS04108 [1,1,0,0,0,0|1,1,0]=4 809 B5R0.3 C[C@@H](CO)CBr TS10268 [1,1,0,0,0,0|0,1,0]=3 810 B5R0.3 C[C@H](CO)CBr TS10271 [1,1,0,0,0,0|0,1,0]=3 811 B5R0.4 C(C(F)(F)F)S TS32180 [1,1,0,0,0,0|2,0,0]=4 812 B5R0.4 CC(C)(C#C)Cl TS00139 [1,1,0,0,0,0|0,0,2]=4 813 B5R0.4 CC(C)(C#C)N TS60199 [1,1,0,0,0,0|0,0,2]=4 814 B5R0.4 CC(C)(C#C)O TS01134 [1,1,0,0,0,0|0,0,2]=4 815 B5R0.4 CC(C)(C#N)N TS03500 [1,1,0,0,0,0|1,0,1]=4 816 B5R0.4 CC(C)(C#N)O TS39666 [1,1,0,0,0,0|1,0,1]=4 817 B5R0.4 CC(C)(C)C#C TS03471 [1,1,0,0,0,0|0,0,2]=4 818 B5R0.4 CC(C)(C)C=C TS71723 [1,1,0,0,0,0|0,0,2]=4 819 B5R0.4 CC(C)(C)C=O TS39621 [1,1,0,0,0,0|0,1,1]=4 820 B5R0.4 CC(C)(C)CBr TS09986 [1,1,0,0,0,0|1,0,0]=3 821 B5R0.4 CC(C)(C)CI TS18545 [1,1,0,0,0,0|1,0,0]=3 822 B5R0.4 CC(C)(C)CN TS48743 [1,1,0,0,0,0|1,0,0]=3 823 B5R0.4 CC(C)(C)CN TS71779 [1,1,0,0,0,0|1,0,0]=3 824 B5R0.4 CC(C)(C)CO TS71802 [1,1,0,0,0,0|0,1,0]=3 825 B5R0.4 CC(C)(C)N=C TS03511 [1,1,0,0,0,0|1,0,1]=4 826 B5R0.4 CC(C)(C)N=O TS45822 [1,1,0,0,0,0|1,1,0]=4 827 B5R0.4 CC(C)(C)NC TS71784 [1,1,0,0,0,0|1,0,0]=3 828 B5R0.4 CC(C)(C)NO TS03606 [1,1,0,0,0,0|1,1,0]=4 829 B5R0.4 CC(C)(C)NO TS36087 [1,1,0,0,0,0|1,1,0]=4 830 B5R0.4 CC(C)(C)OC TS00061 [1,1,0,0,0,0|1,0,0]=3 831 B5R0.4 CC(C)(C)ON TS36088 [1,1,0,0,0,0|2,0,0]=4 832 B5R0.4 CC(C)(C)OO TS71845 [1,1,0,0,0,0|1,1,0]=4 833 B5R0.4 CC(C)(C)SC TS31695 [1,1,0,0,0,0|1,0,0]=3 834 B5R0.4 CC(C)(C)[Mg]Cl TS32261 [1,1,0,0,0,0|2,0,0]=4 835 B5R0.4 CC(C)(C)[N+]#[C-] TS71703 [1,1,0,0,0,0|1,0,1]=4 836 B5R0.4 CC(C)(C=C)Cl TS04056 [1,1,0,0,0,0|0,0,2]=4 837 B5R0.4 CC(C)(C=C)O TS71761 [1,1,0,0,0,0|0,0,2]=4 838 B5R0.4 CC(C)(C=O)[O-] TS82002 [1,1,0,0,0,0|0,1,1]=4 839 B5R0.4 CC(C)(CBr)Br TS21964 [1,1,0,0,0,0|1,0,0]=3 840 B5R0.4 CC(C)(CBr)F TS10538 [1,1,0,0,0,0|1,0,0]=3 841 B5R0.4 CC(C)(CCl)Br TS13061 [1,1,0,0,0,0|1,0,0]=3 842 B5R0.4 CC(C)(CCl)O TS04161 [1,1,0,0,0,0|1,0,0]=3 843 B5R0.4 CC(C)(CF)N TS05291 [1,1,0,0,0,0|1,0,0]=3 844 B5R0.4 CC(C)(CN)N TS94127 [1,1,0,0,0,0|1,0,0]=3 845 B5R0.4 CC(C)(CO)N TS36086 [1,1,0,0,0,0|0,1,0]=3 846 B5R0.4 CC(C)(CO)O TS71839 [1,1,0,0,0,0|0,1,0]=3 847 B5R0.4 CC(CBr)(Br)Br TS54388 [1,1,0,0,0,0|2,0,0]=4 848 B5R0.4 CC(CCl)(F)Cl TS05626 [1,1,0,0,0,0|2,0,0]=4 849 B5R0.4 CC(CN)(F)F TS36635 [1,1,0,0,0,0|2,0,0]=4 850 B5R0.4 CC(CO)(F)F TS34630 [1,1,0,0,0,0|1,1,0]=4 851 B5R0.4 CCC(C)(C)C TS03545 [1,1,0,0,0,0|0,0,0]=2 852 B5R0.4 CCC(C)(C)F TS71847 [1,1,0,0,0,0|0,0,0]=2 853 B5R0.4 CCC(C)(C)I TS18551 [1,1,0,0,0,0|0,0,0]=2 854 B5R0.4 CCC(C)(C)N TS71778 [1,1,0,0,0,0|0,0,0]=2 855 B5R0.4 CCC(C)(C)O TS02090 [1,1,0,0,0,0|0,0,0]=2 856 B5R0.4 CCC(C)(C)S TS31694 [1,1,0,0,0,0|0,0,0]=2 857 B5R0.4 CCC(C)(C)[O-] TS31830 [1,1,0,0,0,0|0,0,0]=2 858 B5R0.4 CCC(C)(C)[O-] TS36175 [1,1,0,0,0,0|0,0,0]=2 859 B5R0.4 CCC(C)(C)[Zn+] TS49170 [1,1,0,0,0,0|0,0,0]=2 860 B5R0.4 CCC(C)(Cl)Cl TS36205 [1,1,0,0,0,0|1,0,0]=3 861 B5R0.4 CCC(F)(F)F TS03753 [1,1,0,0,0,0|2,0,0]=4 862 B5R0.4 CCS(=O)(=O)C TS31782 [1,1,0,0,0,0|1,1,0]=4 863 B5R0.4 CC[Si](C)(C)C TS39386 [1,1,0,0,0,0|0,1,0]=3 864 B5R0.4 CC[Si](C)(C)Cl TS32542 [1,1,0,0,0,0|0,1,0]=3 865 B5R0.4 CC[Si](C)(Cl)Cl TS40046 [1,1,0,0,0,0|1,1,0]=4 866 B5R0.4 CO[Si](C)(C)C TS31701 [1,1,0,0,0,0|1,1,0]=4 867 B5R0.4 CO[Si](C)(C)Cl TS36037 [1,1,0,0,0,0|1,1,0]=4 868 B5R0.4 C[Ge](C)(C)CCl TS12384 [1,1,0,0,0,0|1,1,0]=4 869 B5R0.4 C[N+](C)(C)CI TS77658 [1,1,0,0,0,0|2,0,0]=4 870 B5R0.4 C[Si](C)(C)CBr TS12349 [1,1,0,0,0,0|1,1,0]=4 871 B5R0.4 C[Si](C)(C)CCl TS01757 [1,1,0,0,0,0|1,1,0]=4 872 B5R0.4 C[Si](C)(C)CI TS21629 [1,1,0,0,0,0|1,1,0]=4 873 B5R0.4 C[Si](C)(C)CN TS31648 [1,1,0,0,0,0|1,1,0]=4 874 B5R0.4 C[Si](C)(C)CO TS31702 [1,1,0,0,0,0|0,2,0]=4 875 B5R0.4 C[Si](C)(C)CS TS32443 [1,1,0,0,0,0|0,1,0]=3 876 B5R0.4 C[Si](C)(C)SC TS32442 [1,1,0,0,0,0|1,1,0]=4 877 B5R0.4 C[Si](C)(CBr)Cl TS50605 [1,1,0,0,0,0|1,1,0]=4 878 B5R0.4 C[Si](C)(CCl)Cl TS40045 [1,1,0,0,0,0|1,1,0]=4 879 B5R0.4 C[Sn](C)(C)CCl TS44372 [1,1,0,0,0,0|2,0,0]=4 880 B5R0.4 [Li]CC(C)(C)C TS03430 [1,1,0,0,0,0|1,0,0]=3 881 B7R0.2 CC(C)CC(=NO)C TS32168 [0,1,0,0,0,1|0,1,1]=4 882 B7R0.2 CC(C)CC(=O)OC TS04588 [0,1,0,0,0,1|0,1,1]=4 883 B7R0.2 CC(C)CC(=O)SC TS05775 [0,1,0,0,0,1|0,1,1]=4 884 B7R0.2 CC(C)CC(C#C)O TS04314 [0,1,0,0,0,1|0,1,1]=4 885 B7R0.2 CC(C)CC(C)C=C TS04359 [0,1,0,0,0,1|1,0,0]=3 886 B7R0.2 CC(C)CC(C)CO TS04618 [0,1,0,0,0,1|0,1,0]=3 887 B7R0.2 CC(C)C[C@H](CO)N TS39858 [0,1,0,0,0,1|1,0,0]=3 888 B7R0.2 CC(C)NC(=O)CCl TS06023 [0,1,0,0,0,1|0,1,1]=4 889 B7R0.2 CC(C)OC(=O)CCl TS37073 [0,1,0,0,0,1|0,1,1]=4 890 B7R0.2 CC(C)OC(=O)CN TS41311 [0,1,0,0,0,1|0,1,1]=4 891 B7R0.2 CC(C)OC(=O)CO TS32323 [0,1,0,0,0,1|0,1,1]=4 892 B7R0.2 CC(C)OC(=O)CS TS05924 [0,1,0,0,0,1|0,1,1]=4 893 B7R0.2 CC(C)OC(=S)S[K] TS13576 [0,1,0,0,0,1|1,0,1]=4 894 B7R0.2 CC(C)OC(=S)S[Na] TS11014 [0,1,0,0,0,1|1,0,1]=4 895 B7R0.2 CC(CN(C)C)CCl TS13112 [0,1,0,0,0,1|2,0,0]=4 896 B7R0.2 CCC(=C)CC(C)C TS04352 [0,1,0,0,0,1|1,0,1]=4 897 B7R0.2 CCC(=O)CC(C)C TS32113 [0,1,0,0,0,1|0,1,1]=4 898 B7R0.2 CCC(C)CC(=C)C TS04345 [0,1,0,0,0,1|1,0,1]=4 899 B7R0.2 CCC(C)CC(=O)C TS04467 [0,1,0,0,0,1|0,1,1]=4 900 B7R0.2 CCC(C)CC(C)C TS04502 [0,1,0,0,0,1|1,0,0]=3 901 B7R0.2 CCC(C)CC(C)N TS04563 [0,1,0,0,0,1|1,0,0]=3 902 B7R0.2 CCC(C)CC(C)N TS10102 [0,1,0,0,0,1|1,0,0]=3 903 B7R0.2 CCC(C)CC(C)O TS32253 [0,1,0,0,0,1|0,1,0]=3 904 B7R0.2 CCC(C)OC(=O)C TS32210 [0,1,0,0,0,1|0,1,1]=4 905 B7R0.2 CCC(CC(C)C)O TS32246 [0,1,0,0,0,1|0,1,0]=3 906 B7R0.2 CCC(CC(C)O)O TS32344 [0,1,0,0,0,1|1,1,0]=4 907 B7R0.2 CN(C)CC(CO)O TS65701 [0,1,0,0,0,1|1,1,0]=4 908 B7R0.9 CC(=C)CC(C)(C)C TS31963 [0,1,0,0,0,1|1,0,1]=4 909 B7R0.9 CC(=C)CC(C)(C)O TS04481 [0,1,0,0,0,1|1,0,1]=4 910 B7R0.9 CC(=CC(C)(C)C)C TS31962 [0,1,0,0,0,1|1,0,1]=4 911 B7R0.9 CC(=O)CC(C)(C)C TS32105 [0,1,0,0,0,1|0,1,1]=4 912 B7R0.9 CC(=O)CC(C)(C)N TS23643 [0,1,0,0,0,1|0,1,1]=4 913 B7R0.9 CC(=O)CC(C)(C)O TS03121 [0,1,0,0,0,1|0,1,1]=4 914 B7R0.9 CC(=O)CC(C)(C)S TS02240 [0,1,0,0,0,1|0,1,1]=4 915 B7R0.9 CC(=O)NC(C)(C)C TS32162 [0,1,0,0,0,1|0,1,1]=4 916 B7R0.9 CC(=O)OC(C)(C)C TS33213 [0,1,0,0,0,1|0,1,1]=4 917 B7R0.9 CC(=O)SC(C)(C)C TS05772 [0,1,0,0,0,1|0,1,1]=4 918 B7R0.9 CC(C)(CN(C)C)N TS32256 [0,1,0,0,0,1|2,0,0]=4 919 B7R0.9 CC(C)CC(C)(C)C TS04509 [0,1,0,0,0,1|1,0,0]=3 920 B7R0.9 CC(C)CC(C)(C)Cl TS36884 [0,1,0,0,0,1|1,0,0]=3 921 B7R0.9 CC(C)CC(C)(C)O TS32238 [0,1,0,0,0,1|0,1,0]=3 922 B7R0.9 CC(C)C[Si](C)(C)Cl TS40950 [0,1,0,0,0,1|1,1,0]=4 923 B7R0.9 CC(C)OS(=O)(=O)C TS06289 [0,1,0,0,0,1|1,1,0]=4 924 B7R0.9 CC(C)O[Si](C)(C)C TS36721 [0,1,0,0,0,1|1,1,0]=4 925 B7R0.9 CC(CC(C)(C)C)O TS32234 [0,1,0,0,0,1|0,1,0]=3 926 B7R0.9 CC(C[N+](C)(C)C)O TS27275 [0,1,0,0,0,1|1,1,0]=4 927 B7R0.9 CC(C[N+](C)(C)C)O TS41322 [0,1,0,0,0,1|1,1,0]=4 928 B7R0.9 CC(C[N+](C)(C)C)O TS42592 [0,1,0,0,0,1|1,1,0]=4 929 B7R0.9 C[C@H](CC(C)(C)O)O TS04735 [0,1,0,0,0,1|0,1,0]=3 930 B7R0.16 CC(C(=O)C(C)Br)Br TS27079 [0,1,0,0,0,1|2,0,0]=4 931 B7R0.16 CC(C(=O)N(C)C)Br TS14492 [0,1,0,0,0,1|2,0,0]=4 932 B7R0.16 CC(C(=O)N(C)C)O TS32283 [0,1,0,0,0,1|1,1,0]=4 933 B7R0.16 CC(C(C(C)Br)Br)Br TS60757 [0,1,0,0,0,1|2,0,0]=4 934 B7R0.16 CC(C)C(=C(C)C)C TS31980 [0,1,0,0,0,1|1,0,1]=4 935 B7R0.16 CC(C)C(=O)C(C)C TS04472 [0,1,0,0,0,1|1,0,0]=3 936 B7R0.16 CC(C)C(C(=C)C)O TS32111 [0,1,0,0,0,1|1,0,1]=4 937 B7R0.16 CC(C)C(C(C)C)Cl TS36885 [0,1,0,0,0,1|1,0,0]=3 938 B7R0.16 CC(C)C(C(C)C)O TS04627 [0,1,0,0,0,1|1,0,0]=3 939 B7R0.16 CC(C)C(C)C(C)C TS32119 [0,1,0,0,0,1|1,0,0]=3 940 B7R0.16 CC(C)N(C)C(C)C TS04551 [0,1,0,0,0,1|1,0,0]=3 941 B7R0.16 CC(C)P(C(C)C)Cl TS41217 [0,1,0,0,0,1|1,0,0]=3 942 B7R0.16 CC(C)[SiH](C(C)C)Cl TS40948 [0,1,0,0,0,1|1,0,0]=3 943 B7R0.5 CC(C)C(=O)CC#N TS60063 [0,2,0,0,0,0|0,1,1]=4 944 B7R0.5 CC(C)C(C)CC=C TS04343 [0,2,0,0,0,0|1,0,0]=3 945 B7R0.5 CC(C)C(C)N=C=S TS36440 [0,2,0,0,0,0|0,0,1]=3 946 B7R0.5 CC(C)C(CC=C)O TS32108 [0,2,0,0,0,0|0,1,0]=3 947 B7R0.5 CC(C)N(C)CCO TS32296 [0,2,0,0,0,0|1,1,0]=4 948 B7R0.5 CC=CC(C(C)C)O TS04483 [0,2,0,0,0,0|0,1,0]=3 949 B7R0.5 CCC=C(C)C(C)C TS31953 [0,2,0,0,0,0|1,0,1]=4 950 B7R0.5 CCC=C(C)C(C)O TS04482 [0,2,0,0,0,0|0,1,1]=4 951 B7R0.5 CCCC(=C)C(C)C TS04341 [0,2,0,0,0,0|1,0,1]=4 952 B7R0.5 CCCC(=O)C(C)C TS32114 [0,2,0,0,0,0|0,1,1]=4 953 B7R0.5 CCCC(C(C)Br)Br TS61926 [0,2,0,0,0,0|2,0,0]=4 954 B7R0.5 CCCC(C(C)C)O TS32239 [0,2,0,0,0,0|0,1,0]=3 955 B7R0.5 CCCC(C)C(=C)C TS31970 [0,2,0,0,0,0|1,0,1]=4 956 B7R0.5 CCCC(C)C(=O)C TS04464 [0,2,0,0,0,0|0,1,1]=4 957 B7R0.5 CCCC(C)C(C)C TS04507 [0,2,0,0,0,0|1,0,0]=3 958 B7R0.5 CCCC(C)C(C)O TS32245 [0,2,0,0,0,0|0,1,0]=3 959 B7R0.5 CCNC(C)C(C)C TS04548 [0,2,0,0,0,0|1,0,0]=3 960 B7R0.5 CCOC(=O)C(C)C TS32217 [0,2,0,0,0,0|0,1,1]=4 961 B7R0.5 CCOC(=O)C(C)S TS05920 [0,2,0,0,0,0|1,0,1]=4 962 B7R0.10 C(C(C(CBr)Br)Br)Br TS80123 [0,2,0,0,0,0|2,0,0]=4 963 B7R0.10 C(C(C(CBr)O)O)Br TS27686 [0,2,0,0,0,0|1,1,0]=4 964 B7R0.10 C(C(C(CO)Br)Br)O TS85188 [0,2,0,0,0,0|2,0,0]=4 965 B7R0.10 C([C@@H]([C@H](CO)O)O)O TS32487 [0,2,0,0,0,0|1,1,0]=4 966 B7R0.10 C([C@@H]([C@H](CS)O)O)S TS41446 [0,2,0,0,0,0|1,1,0]=4 967 B7R0.10 C([C@H]([C@@H](CO)O)O)O TS32486 [0,2,0,0,0,0|1,1,0]=4 968 B7R0.10 C([C@H]([C@@H](CS)O)O)S TS41447 [0,2,0,0,0,0|1,1,0]=4 969 B7R0.10 C([C@H]([C@H](CBr)Br)Br)Br TS80124 [0,2,0,0,0,0|2,0,0]=4 970 B7R0.10 C([C@H]([C@H](CS)O)O)S TS41444 [0,2,0,0,0,0|1,1,0]=4 971 B7R0.10 CC(C(=O)OC)OC TS32317 [0,2,0,0,0,0|0,1,1]=4 972 B7R0.10 CC(C(=O)OC)SC TS05922 [0,2,0,0,0,0|0,1,1]=4 973 B7R0.10 CCC(C(C)C=O)S TS05778 [0,2,0,0,0,0|0,0,1]=3 974 B7R0.10 CCC(C(C)CO)S TS36877 [0,2,0,0,0,0|0,0,0]=2 975 B7R0.10 CCC(C(CC)Br)Br TS61927 [0,2,0,0,0,0|2,0,0]=4 976 B7R0.10 CCC(C)C(=C)CC TS04351 [0,2,0,0,0,0|1,0,1]=4 977 B7R0.10 CCC(C)C(=CC)C TS04350 [0,2,0,0,0,0|1,0,1]=4 978 B7R0.10 CCC(C)C(=O)CC TS04477 [0,2,0,0,0,0|0,1,1]=4 979 B7R0.10 CCC(C)C(=O)OC TS04590 [0,2,0,0,0,0|0,1,1]=4 980 B7R0.10 CCC(C)C(=O)SC TS05776 [0,2,0,0,0,0|0,1,1]=4 981 B7R0.10 CCC(C)C(C)C=C TS04364 [0,2,0,0,0,0|1,0,0]=3 982 B7R0.10 CCC(C)C(C)C=O TS04460 [0,2,0,0,0,0|0,1,0]=3 983 B7R0.10 CCC(C)C(C)CC TS04508 [0,2,0,0,0,0|1,0,0]=3 984 B7R0.10 CCC(C)C(C)CO TS32242 [0,2,0,0,0,0|0,1,0]=3 985 B7R0.10 CCC(C)C(CC)O TS04626 [0,2,0,0,0,0|0,1,0]=3 986 B7R0.10 CC[C@@H](C)[C@H](CO)N TS22803 [0,2,0,0,0,0|1,0,0]=3 987 B7R0.10 C[C@@H](C(=O)OC)NC TS41312 [0,2,0,0,0,0|0,1,1]=4 988 B7R0.10 C[C@@H](CBr)C(=O)OC TS14724 [0,2,0,0,0,0|0,1,1]=4 989 B7R0.10 C[C@@H](CO)C(=O)OC TS59397 [0,2,0,0,0,0|0,1,1]=4 990 B7R0.10 C[C@H](CBr)C(=O)OC TS14720 [0,2,0,0,0,0|0,1,1]=4 991 B7R0.10 C[C@H](CO)C(=O)OC TS32320 [0,2,0,0,0,0|0,1,1]=4 992 B7R0.13 CC(=C)C(C)(C)C=C TS31854 [0,2,0,0,0,0|1,0,1]=4 993 B7R0.13 CC(C)(CO)N(C)C TS32298 [0,2,0,0,0,0|1,1,0]=4 994 B7R0.13 CC(C)C(C)(C#C)O TS04318 [0,2,0,0,0,0|0,1,0]=3 995 B7R0.13 CC(C)C(C)(C#N)N TS04324 [0,2,0,0,0,0|1,0,0]=3 996 B7R0.13 CCC(C)(C(C)C)O TS32233 [0,2,0,0,0,0|0,1,0]=3 997 B7R0.13 CCC(C)(C)C(C)C TS04505 [0,2,0,0,0,0|1,0,0]=3 998 B7R0.13 CCC(C)(C)C(C)O TS32243 [0,2,0,0,0,0|0,1,0]=3 999 B7R0.14 CC(=NO)C(C)(C)C TS32159 [0,2,0,0,0,0|0,1,1]=4 1000 B7R0.14 CC(=NO)C(C)(C)O TS32282 [0,2,0,0,0,0|0,1,1]=4 1001 B7R0.14 CC(C)(C(=O)OC)Br TS60142 [0,2,0,0,0,0|0,1,1]=4 1002 B7R0.14 CC(C)(C(=O)OC)F TS56254 [0,2,0,0,0,0|0,1,1]=4 1003 B7R0.14 CC(C)(C(=O)OC)N TS01337 [0,2,0,0,0,0|0,1,1]=4 1004 B7R0.14 CC(C)(C(=O)OC)O TS04713 [0,2,0,0,0,0|0,1,1]=4 1005 B7R0.14 CC(C)(C)C(=O)CBr TS47672 [0,2,0,0,0,0|0,1,1]=4 1006 B7R0.14 CC(C)(C)C(=O)CCl TS00046 [0,2,0,0,0,0|0,1,1]=4 1007 B7R0.14 CC(C)(C)C(=O)NC TS32150 [0,2,0,0,0,0|0,1,1]=4 1008 B7R0.14 CC(C)(C)C(=O)OC TS32211 [0,2,0,0,0,0|0,1,1]=4 1009 B7R0.14 CC(C)(C)C(CBr)O TS48032 [0,2,0,0,0,0|0,1,0]=3 1010 B7R0.14 CC(C)(C)C(CO)O TS04741 [0,2,0,0,0,0|0,1,0]=3 1011 B7R0.14 CC(C)(C)[C@@H](CO)N TS59651 [0,2,0,0,0,0|1,0,0]=3 1012 B7R0.14 CC(C=C)C(C)(C)O TS04471 [0,2,0,0,0,0|1,0,0]=3 1013 B7R0.14 CC=C(C)C(C)(C)C TS31978 [0,2,0,0,0,0|1,0,1]=4 1014 B7R0.14 CCC(=O)C(C)(C)C TS04479 [0,2,0,0,0,0|0,1,1]=4 1015 B7R0.14 CCC(C(C)(C)C)O TS32235 [0,2,0,0,0,0|0,1,0]=3 1016 B7R0.14 CCC(C)C(C)(C)C TS32123 [0,2,0,0,0,0|1,0,0]=3 1017 B7R0.14 C[Si](C)(C)C(CBr)Br TS29416 [0,2,0,0,0,0|1,1,0]=4 1018 B7R0.15 CC(=O)C(OC)OC TS01675 [0,2,0,0,0,0|0,1,1]=4 1019 B7R0.15 CCC(=CC)C(C)C TS31976 [0,2,0,0,0,0|1,0,1]=4 1020 B7R0.15 CCC(C=O)C(C)C TS32780 [0,2,0,0,0,0|0,1,0]=3 1021 B7R0.15 CCC(CC)C(=C)C TS31969 [0,2,0,0,0,0|1,0,1]=4 1022 B7R0.15 CCC(CC)C(=O)C TS04458 [0,2,0,0,0,0|0,1,1]=4 1023 B7R0.15 CCC(CC)C(C)C TS04501 [0,2,0,0,0,0|1,0,0]=3 1024 B7R0.15 CCC(CC)C(C)O TS32240 [0,2,0,0,0,0|0,1,0]=3 1025 B7R0.15 CC[SiH](CC)C(C)C TS36559 [0,2,0,0,0,0|1,1,0]=4 1026 B7R0.15 CN(C)C(OC)OC TS01575 [0,2,0,0,0,0|1,1,0]=4 1027 B7R0.17 CC(C)(C(C)(C)O)O TS16625 [0,2,0,0,0,0|0,1,0]=3 1028 B7R0.17 CC(C)(C(Cl)(Cl)Cl)O TS46344 [0,2,0,0,0,0|2,0,0]=4 1029 B7R0.17 CC(C)(C(F)(F)F)O TS36261 [0,2,0,0,0,0|2,0,0]=4 1030 B7R0.17 CC(C)(C)C(C)(C)C TS04504 [0,2,0,0,0,0|1,0,0]=3 1031 B7R0.17 CC(C)(C)C(C)(C)Cl TS05958 [0,2,0,0,0,0|1,0,0]=3 1032 B7R0.17 CC(C)(C)C(C)(C)O TS04621 [0,2,0,0,0,0|0,1,0]=3 1033 B7R0.17 CC(C)(C)[Ge](C)(C)Cl TS52051 [0,2,0,0,0,0|1,1,0]=4 1034 B7R0.17 CC(C)(C)[Si](C)(C)Cl TS01704 [0,2,0,0,0,0|1,1,0]=4 1035 B7R0.17 CC(C)(C)[Si](C)(C)O TS36719 [0,2,0,0,0,0|0,2,0]=4 1036 B5R1.2 C1C(=O)CS1 TS90454 [1,0,0,1,0,0|1,0,1]=4 1037 B5R1.2 C1C(CN1)N TS88575 [1,0,0,1,0,0|2,0,0]=4 1038 B5R1.2 C1C(CN1)N TS92985 [1,0,0,1,0,0|2,0,0]=4 1039 B5R1.2 C1C(CN1)O TS00225 [1,0,0,1,0,0|1,1,0]=4 1040 B5R1.2 C1C(CN1)O TS65705 [1,0,0,1,0,0|1,1,0]=4 1041 B5R1.2 C1C(CN1)S TS87598 [1,0,0,1,0,0|1,0,0]=3 1042 B5R1.2 C1C(CO1)Br TS65955 [1,0,0,1,0,0|1,1,0]=4 1043 B5R1.2 C1C(CO1)Cl TS91374 [1,0,0,1,0,0|1,1,0]=4 1044 B5R1.2 C1C(CO1)I TS70631 [1,0,0,1,0,0|1,1,0]=4 1045 B5R1.2 C1C(CO1)N TS90822 [1,0,0,1,0,0|1,1,0]=4 1046 B5R1.2 C1C(CO1)O TS02791 [1,0,0,1,0,0|1,1,0]=4 1047 B5R1.2 C1C(CO1)S TS90997 [1,0,0,1,0,0|1,0,0]=3 1048 B5R1.2 C1C(CS1)N TS85859 [1,0,0,1,0,0|1,0,0]=3 1049 B5R1.2 C1CC(=O)C1 TS01399 [1,0,0,1,0,0|0,1,1]=4 1050 B5R1.2 C1CC(C1)Br TS36910 [1,0,0,1,0,0|1,0,0]=3 1051 B5R1.2 C1CC(C1)Cl TS03632 [1,0,0,1,0,0|1,0,0]=3 1052 B5R1.2 C1CC(C1)N TS03375 [1,0,0,1,0,0|1,0,0]=3 1053 B5R1.2 C1CC(C1)N TS04122 [1,0,0,1,0,0|1,0,0]=3 1054 B5R1.2 C1CC(C1)O TS59758 [1,0,0,1,0,0|0,1,0]=3 1055 B5R1.2 CC1CCN1 TS71588 [1,0,0,1,0,0|1,0,0]=3 1056 B5R1.3 C#CC1CC1 TS02742 [1,0,0,1,0,0|0,0,2]=4 1057 B5R1.3 C1C(O1)CBr TS06154 [1,0,0,1,0,0|1,1,0]=4 1058 B5R1.3 C1C(O1)CCl TS08941 [1,0,0,1,0,0|1,1,0]=4 1059 B5R1.3 C1C(O1)CCl TS94501 [1,0,0,1,0,0|1,1,0]=4 1060 B5R1.3 C1C(O1)CCl TS94502 [1,0,0,1,0,0|1,1,0]=4 1061 B5R1.3 C1C(O1)CF TS71640 [1,0,0,1,0,0|1,1,0]=4 1062 B5R1.3 C1C(O1)CO TS03389 [1,0,0,1,0,0|1,1,0]=4 1063 B5R1.3 C1CC1C#N TS16796 [1,0,0,1,0,0|1,0,1]=4 1064 B5R1.3 C1CC1C=O TS55830 [1,0,0,1,0,0|0,1,1]=4 1065 B5R1.3 C1CC1CBr TS46573 [1,0,0,1,0,0|1,0,0]=3 1066 B5R1.3 C1CC1CCl TS46576 [1,0,0,1,0,0|1,0,0]=3 1067 B5R1.3 C1CC1CN TS03376 [1,0,0,1,0,0|1,0,0]=3 1068 B5R1.3 C1CC1CN TS04123 [1,0,0,1,0,0|1,0,0]=3 1069 B5R1.3 C1CC1CO TS34565 [1,0,0,1,0,0|0,1,0]=3 1070 B5R1.3 C1CC1ON TS94064 [1,0,0,1,0,0|2,0,0]=4 1071 B5R1.3 C1CC1[Mg]Br TS59761 [1,0,0,1,0,0|2,0,0]=4 1072 B5R1.3 C1[C@@H](O1)CCl TS00305 [1,0,0,1,0,0|1,1,0]=4 1073 B5R1.3 C1[C@@H](O1)CO TS00321 [1,0,0,1,0,0|1,1,0]=4 1074 B5R1.3 C1[C@H](O1)CCl TS46636 [1,0,0,1,0,0|1,1,0]=4 1075 B5R1.3 C1[C@H](O1)CO TS01969 [1,0,0,1,0,0|1,1,0]=4 1076 B5R1.3 C=CC1CC1 TS02996 [1,0,0,1,0,0|0,0,2]=4 1077 B5R1.3 CCC1CC1 TS03362 [1,0,0,1,0,0|0,0,0]=2 1078 B5R1.3 CCC1CO1 TS71603 [1,0,0,1,0,0|0,1,0]=3 1079 B5R1.3 CC[C@@H]1CO1 TS71607 [1,0,0,1,0,0|0,1,0]=3 1080 B5R1.3 CC[C@H]1CO1 TS71606 [1,0,0,1,0,0|0,1,0]=3 1081 B5R1.3 CNC1CC1 TS87062 [1,0,0,1,0,0|1,0,0]=3 1082 B5R1.3 [C-]#[N+]C1CC1 TS02923 [1,0,0,1,0,0|1,0,1]=4 1083 B5R1.4 CC1C(O1)C TS71602 [1,0,0,1,0,0|0,1,0]=3 1084 B5R1.4 C[C@@H]1C[C@@H]1C TS03365 [1,0,0,1,0,0|0,0,0]=2 1085 B5R1.4 C[C@@H]1C[C@H]1C TS03366 [1,0,0,1,0,0|0,0,0]=2 1086 B5R1.4 C[C@@H]1[C@@H](O1)C TS71599 [1,0,0,1,0,0|0,1,0]=3 1087 B5R1.4 C[C@H]1[C@@H](O1)C TS71605 [1,0,0,1,0,0|0,1,0]=3 1088 B5R1.5 CC1(CC1)N TS04124 [1,0,0,1,0,0|1,0,0]=3 1089 B5R1.5 CC1(CN1)C TS71587 [1,0,0,1,0,0|1,0,0]=3 1090 B5R1.5 CC1(CS1)C TS71812 [1,0,0,1,0,0|0,0,0]=2 1091 B7R1.2 C1CC(CC1N)N TS03878 [0,0,0,1,0,1|2,0,0]=4 1092 B7R1.2 C1CC(CC1N)O TS86416 [0,0,0,1,0,1|1,1,0]=4 1093 B7R1.2 C1C[C@@H](C[C@@H]1N)O TS85957 [0,0,0,1,0,1|1,1,0]=4 1094 B7R1.2 C1C[C@@H](C[C@H]1N)O TS87237 [0,0,0,1,0,1|1,1,0]=4 1095 B7R1.2 CC1CCC(N1)C TS94712 [0,0,0,1,0,1|1,0,0]=3 1096 B7R1.2 CC1CCC(O1)C TS47281 [0,0,0,1,0,1|1,0,0]=3 1097 B7R1.2 CC1COC(O1)C TS03942 [0,0,0,1,0,1|0,1,0]=3 1098 B7R1.2 CN1CCC(C1)N TS03871 [0,0,0,1,0,1|2,0,0]=4 1099 B7R1.2 CN1CCC(C1)O TS31556 [0,0,0,1,0,1|1,1,0]=4 1100 B7R1.2 CN1CC[C@@H](C1)N TS86663 [0,0,0,1,0,1|2,0,0]=4 1101 B7R1.2 CN1CC[C@@H](C1)O TS03901 [0,0,0,1,0,1|1,1,0]=4 1102 B7R1.2 CN1CC[C@H](C1)O TS03903 [0,0,0,1,0,1|1,1,0]=4 1103 B7R1.2 C[C@@H]1CCC(=O)O1 TS31495 [0,0,0,1,0,1|0,1,1]=4 1104 B7R1.2 C[C@@H]1CC[C@@H](C1)C TS03800 [0,0,0,1,0,1|1,0,0]=3 1105 B7R1.2 C[C@H]1CC[C@@H](C1)C TS31449 [0,0,0,1,0,1|1,0,0]=3 1106 B7R1.16 CC1(CC(C1)N)C TS93165 [0,0,0,1,0,1|1,0,0]=3 1107 B7R1.16 CC1(CC(C1)O)N TS92716 [0,0,0,1,0,1|1,1,0]=4 1108 B7R1.16 C[C@]1(C[C@@H](C1)N)O TS92450 [0,0,0,1,0,1|1,1,0]=4 1109 B7R1.16 C[C@]1(C[C@@H](C1)O)N TS92507 [0,0,0,1,0,1|1,1,0]=4 1110 B7R1.16 C[C@]1(C[C@H](C1)N)O TS92834 [0,0,0,1,0,1|1,1,0]=4 1111 B7R1.16 C[C@]1(C[C@H](C1)O)N TS92207 [0,0,0,1,0,1|1,1,0]=4 1112 B7R1.32 CC1(C(O1)(C)C)C TS31504 [0,0,0,1,0,1|1,0,0]=3 1113 B7R1.32 CC1(CC1(C)C)C TS03802 [0,0,0,1,0,1|1,0,0]=3 1114 B7R1.4 C1CC(C(C1)Cl)Cl TS06337 [0,1,0,1,0,0|2,0,0]=4 1115 B7R1.4 C1CC(C(C1)O)N TS03905 [0,1,0,1,0,0|1,1,0]=4 1116 B7R1.4 C1COC(C1Br)Br TS52914 [0,1,0,1,0,0|2,0,0]=4 1117 B7R1.4 C1COC(C1Cl)Cl TS37466 [0,1,0,1,0,0|2,0,0]=4 1118 B7R1.4 C1C[C@@H]([C@H](C1)O)N TS59451 [0,1,0,1,0,0|1,1,0]=4 1119 B7R1.4 C1C[C@@H]([C@H](C1)O)O TS03951 [0,1,0,1,0,0|1,1,0]=4 1120 B7R1.4 C1C[C@H]([C@@H](C1)Cl)Cl TS06338 [0,1,0,1,0,0|2,0,0]=4 1121 B7R1.4 C1C[C@H]([C@@H](C1)O)N TS94575 [0,1,0,1,0,0|1,1,0]=4 1122 B7R1.4 C1C[C@H]([C@@H](C1)O)O TS03935 [0,1,0,1,0,0|1,1,0]=4 1123 B7R1.4 C1C[C@H]([C@H](C1)O)N TS55819 [0,1,0,1,0,0|1,1,0]=4 1124 B7R1.4 C1C[C@H]([C@H](C1)O)O TS03956 [0,1,0,1,0,0|1,1,0]=4 1125 B7R1.4 C1[C@@H]([C@H](CN1)F)F TS92386 [0,1,0,1,0,0|2,0,0]=4 1126 B7R1.4 C1[C@@H]([C@H](CN1)O)O TS87014 [0,1,0,1,0,0|1,1,0]=4 1127 B7R1.4 C1[C@@H]([C@H](CO1)N)N TS92585 [0,1,0,1,0,0|2,0,0]=4 1128 B7R1.4 C1[C@@H]([C@H](CO1)N)N TS92586 [0,1,0,1,0,0|2,0,0]=4 1129 B7R1.4 C1[C@@H]([C@H](CO1)O)O TS31674 [0,1,0,1,0,0|1,1,0]=4 1130 B7R1.4 C1[C@H]([C@@H](CN1)F)O TS92108 [0,1,0,1,0,0|1,1,0]=4 1131 B7R1.4 C1[C@H]([C@@H](CN1)O)O TS89590 [0,1,0,1,0,0|1,1,0]=4 1132 B7R1.4 C1[C@H]([C@@H](CO1)N)N TS87919 [0,1,0,1,0,0|2,0,0]=4 1133 B7R1.4 C1[C@H]([C@H](CN1)F)F TS92089 [0,1,0,1,0,0|2,0,0]=4 1134 B7R1.4 C1[C@H]([C@H](CN1)O)O TS91803 [0,1,0,1,0,0|1,1,0]=4 1135 B7R1.4 C1[C@H]([C@H](CO1)N)N TS87566 [0,1,0,1,0,0|2,0,0]=4 1136 B7R1.4 CC1=C(CCO1)S TS04610 [0,1,0,1,0,0|0,0,2]=4 1137 B7R1.4 CC1=C(CCO1)S TS11013 [0,1,0,1,0,0|0,0,2]=4 1138 B7R1.4 CC1=[N+](CCS1)C TS26975 [0,1,0,1,0,0|1,0,1]=4 1139 B7R1.4 CC1C(=O)CCO1 TS31501 [0,1,0,1,0,0|0,1,1]=4 1140 B7R1.4 CC1C(=O)CCS1 TS04612 [0,1,0,1,0,0|0,1,1]=4 1141 B7R1.4 CC1C(CCO1)S TS32361 [0,1,0,1,0,0|0,0,0]=2 1142 B7R1.4 CC1CCC=C1C TS31386 [0,1,0,1,0,0|1,0,1]=4 1143 B7R1.4 CC1CCNC1=O TS70662 [0,1,0,1,0,0|0,1,1]=4 1144 B7R1.4 CC1CCOC1=O TS59696 [0,1,0,1,0,0|0,1,1]=4 1145 B7R1.4 C[C@@H]1CCC[C@@H]1C TS03788 [0,1,0,1,0,0|1,0,0]=3 1146 B7R1.4 C[C@@H]1CCC[C@H]1C TS03797 [0,1,0,1,0,0|1,0,0]=3 1147 B7R1.8 C1CC(=O)C1CO TS92430 [0,1,0,1,0,0|0,1,1]=4 1148 B7R1.8 CN1CCC1CN TS92300 [0,1,0,1,0,0|2,0,0]=4 1149 B7R1.8 CN1CC[C@@H]1CN TS91985 [0,1,0,1,0,0|2,0,0]=4 1150 B7R1.8 CN1CC[C@H]1CN TS92777 [0,1,0,1,0,0|2,0,0]=4 1151 B7R1.18 CN(C)C1CNC1 TS90389 [0,1,0,1,0,0|2,0,0]=4 1152 B7R1.19 CC(=O)C1(CC1)C TS31439 [0,1,0,1,0,0|0,1,1]=4 1153 B7R1.22 C1CC1C(=O)CBr TS55070 [0,1,0,1,0,0|0,1,1]=4 1154 B7R1.22 CC(=NO)C1CC1 TS03823 [0,1,0,1,0,0|0,1,1]=4 1155 B7R1.22 CCC(C)C1CC1 TS03799 [0,1,0,1,0,0|1,0,0]=3 1156 B7R1.22 COC(=O)C1CC1 TS77154 [0,1,0,1,0,0|0,1,1]=4 1157 B7R1.23 C1C(C1(Cl)Cl)CO TS06548 [0,1,0,1,0,0|2,0,0]=4 1158 B7R1.23 C1C(C1(F)F)CBr TS12950 [0,1,0,1,0,0|2,0,0]=4 1159 B7R1.23 CC1(C(O1)OC)C TS03950 [0,1,0,1,0,0|0,1,0]=3 1160 B7R1.23 CC1(CC1C#N)C TS03696 [0,1,0,1,0,0|1,0,0]=3 1161 B7R1.30 CC1C(C1(Cl)Cl)C TS06339 [0,1,0,1,0,0|2,0,0]=4 1162 B7R1.26 CC(C)(C1CC1)O TS31531 [0,1,0,1,0,0|0,1,0]=3 1163 B7R2.1 C1C(O1)C2CO2 TS71738 [0,0,0,2,0,0|1,1,0]=4 1164 B7R0.6 CC(C#CC(C)O)O TS04441 [0,0,0,0,0,2|1,1,0]=4 1165 B7R0.6 CC(C)C=CC(=O)C TS01150 [0,0,0,0,0,2|0,1,1]=4 1166 B7R0.6 CC(C)C=CC(C)C TS31957 [0,0,0,0,0,2|1,0,0]=3 1167 B7R0.6 CC(C)CCC(=C)C TS31967 [0,0,0,0,0,2|1,0,1]=4 1168 B7R0.6 CC(C)CCC(=O)C TS32095 [0,0,0,0,0,2|0,1,1]=4 1169 B7R0.6 CC(C)CCC(C)C TS04511 [0,0,0,0,0,2|1,0,0]=3 1170 B7R0.6 CC(C)CCC(C)N TS04558 [0,0,0,0,0,2|1,0,0]=3 1171 B7R0.6 CC(C)CCC(C)O TS32237 [0,0,0,0,0,2|0,1,0]=3 1172 B7R0.6 CC(C)COC(=O)C TS04598 [0,0,0,0,0,2|0,1,1]=4 1173 B7R0.6 CC(C)SSC(C)C TS40936 [0,0,0,0,0,2|1,0,0]=3 1174 B7R0.6 CC(C=CC(C)O)O TS04595 [0,0,0,0,0,2|1,1,0]=4 1175 B7R0.6 CC(CCC(C)Br)Br TS61928 [0,0,0,0,0,2|2,0,0]=4 1176 B7R0.6 CC(CCC(C)O)O TS04747 [0,0,0,0,0,2|1,1,0]=4